2-[(4-bromo-phenyl)-(4,5,6,7-tetrahydro-3H-azepin-2-yl)-amino]-1-(4-cyclohexyl-phenyl)-ethanone

SpectraBase Compound ID	D18JMe91bd9
InChI	InChI=1S/C26H31BrN2O.Br/c27-23-14-16-24(17-15-23)29(26-9-5-2-6-18-28-26)19-25(30)22-12-10-21(11-13-22)20-7-3-1-4-8-20;/h10-17,20H,1-9,18-19H2;
InChIKey	LLSUFKXUSOKOJF-UHFFFAOYSA-N Google Search
Mol Weight	547.36 g/mol
Molecular Formula	C26H31Br2N2O
Exact Mass	545.080315 g/mol

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SpectraBase Spectrum ID	C6spa5gQARk
Name	2-[(4-bromo-phenyl)-(4,5,6,7-tetrahydro-3H-azepin-2-yl)-amino]-1-(4-cyclohexyl-phenyl)-ethanone
Alternate Name(s)	2-[(4-bromophenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethanone hydrobromide 2-[4-bromo(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-(4-cyclohexylphenyl)ethanone hydrobromide 2-[4-bromo-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-(4-cyclohexylphenyl)ethanone hydrobromide 2-[(4-bromophenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethanone;hydrobromide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H32Br2N2O
InChI	InChI=1S/C26H31BrN2O.Br/c27-23-14-16-24(17-15-23)29(26-9-5-2-6-18-28-26)19-25(30)22-12-10-21(11-13-22)20-7-3-1-4-8-20;/h10-17,20H,1-9,18-19H2;
InChIKey	LLSUFKXUSOKOJF-UHFFFAOYSA-N
Molecular Weight	548.363 g/mol
SMILES	Br.C1CCC(N(CC(c2ccc(cc2)C2CCCCC2)=O)c2ccc(cc2)Br)=NCC1
SPLASH	splash10-0002-9750100000-9cf451bfc613c3977231
Wiley ID	1436331