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(E)-3-(4-chlorophenyl)-N-[4-[2-(4-methylphenyl)ethanoylamino]-3-(phenylcarbonyl)phenyl]prop-2-enamide
SpectraBase Compound ID BHrnP9WT8OX
InChI InChI=1S/C31H25ClN2O3/c1-21-7-9-23(10-8-21)19-30(36)34-28-17-16-26(20-27(28)31(37)24-5-3-2-4-6-24)33-29(35)18-13-22-11-14-25(32)15-12-22/h2-18,20H,19H2,1H3,(H,33,35)(H,34,36)/b18-13+
InChIKey DAEGEAGCVRXVSR-QGOAFFKASA-N
Mol Weight 509.01 g/mol
Molecular Formula C31H25ClN2O3
Exact Mass 508.15537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hFse40jOy
Name (E)-3-(4-chlorophenyl)-N-[4-[2-(4-methylphenyl)ethanoylamino]-3-(phenylcarbonyl)phenyl]prop-2-enamide
Alternate Name(s) N-[3-Benzoyl-4-[(4-methylphenyl)acetylamino]phenyl]-4-chlorocinnamic acid amide (E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-(4-chlorophenyl)-2-propenamide (E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-(4-chlorophenyl)prop-2-enamide (E)-N-[3-benzoyl-4-[[2-(p-tolyl)acetyl]amino]phenyl]-3-(4-chlorophenyl)acrylamide (E)-N-(3-benzoyl-4-(2-(p-tolyl)acetamido)phenyl)-3-(4-chlorophenyl)acrylamide (E)-N-[3-benzoyl-4-[[2-(p-tolyl)acetyl]amino]phenyl]-3-(4-chlorophenyl)prop-2-enamide
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Formula C31H25ClN2O3
InChI InChI=1S/C31H25ClN2O3/c1-21-7-9-23(10-8-21)19-30(36)34-28-17-16-26(20-27(28)31(37)24-5-3-2-4-6-24)33-29(35)18-13-22-11-14-25(32)15-12-22/h2-18,20H,19H2,1H3,(H,33,35)(H,34,36)/b18-13+
InChIKey DAEGEAGCVRXVSR-QGOAFFKASA-N
Literature Reference DOI 10.1002/ardp.200400871
Molecular Weight 509.005 g/mol
SMILES N(c1ccc(c(c1)C(=O)c1ccccc1)NC(Cc1ccc(cc1)C)=O)C(\C=C\c1ccc(cc1)Cl)=O
SPLASH splash10-0bt9-0950040000-b5b39a615dcfa1ef47de
Source of Spectrum APP-337-498-2r
Wiley ID 1770873