Benzenepropanoic acid, .alpha.-cyano-.alpha.-[(4-nitrophenyl)azo]-, ethyl ester

SpectraBase Compound ID	CIBRb8kpU6T
InChI	InChI=1S/C18H16N4O4/c1-2-26-18(23)16(12-19)17(13-6-4-3-5-7-13)21-20-14-8-10-15(11-9-14)22(24)25/h3-11,16-17H,2H2,1H3/b21-20+
InChIKey	BNYGKRFEIMSPCH-QZQOTICOSA-N Google Search
Mol Weight	352.35 g/mol
Molecular Formula	C18H16N4O4
Exact Mass	352.117155 g/mol

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SpectraBase Spectrum ID	6gCslCvDQMy
Name	Benzenepropanoic acid, .alpha.-cyano-.alpha.-[(4-nitrophenyl)azo]-, ethyl ester
Alternate Name(s)	(4-nitrophenylazo)-benzyl cyano acetic acid ethyl ester Ethyl 2-cyano-3-[(E)-(4-nitrophenyl)diazenyl]-3-phenylpropanoate N-nitrophenyl-N'-(1-cyano-1-ethoxycarbonyl-2-phenyl-ethyl)-diazene
CAS Registry Number	64710-76-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H16N4O4
InChI	InChI=1S/C18H16N4O4/c1-2-26-18(23)16(12-19)17(13-6-4-3-5-7-13)21-20-14-8-10-15(11-9-14)22(24)25/h3-11,16-17H,2H2,1H3/b21-20+
InChIKey	BNYGKRFEIMSPCH-QZQOTICOSA-N
Molecular Weight	352.350 g/mol
SMILES	c1(N(=O)=O)ccc(\N=N\C(C(C(=O)OCC)C#N)c2ccccc2)cc1
SPLASH	splash10-0a6u-9500000000-506de668a95bdfacc955
Source of Spectrum	O-12-104-4
Wiley ID	1343104