2-[2-acetyloxyethyl-[2-chloranyl-4-[(2-cyano-3-nitro-phenyl)diazenyl]phenyl]amino]ethyl ethanoate

Systemtic Name: 2-[2-acetyloxyethyl-[2-chloranyl-4-[(2-cyano-3-nitro-phenyl)diazenyl]phenyl]amino]ethyl ethanoate Openeye Name: 2-[N-(2-acetoxyethyl)-2-chloro-4-(2-cyano-3-nitro-phenyl)azo-anilino]ethyl acetate CAS Name: acetic acid 2-[N-(2-acetyloxyethyl)-2-chloro-4-(2-cyano-3-nitrophenyl)azoanilino]ethyl ester IUPAC Name: 2-[N-(2-acetyloxyethyl)-2-chloro-4-[(2-cyano-3-nitrophenyl)diazenyl]anilino]ethyl acetate Traditional Name: acetic acid 2-[N-(2-acetoxyethyl)-2-chloro-4-(2-cyano-3-nitro-phenyl)azo-anilino]ethyl ester Formula: C21H20ClN5O6 MolecularWeight: 473.8664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(CCOC(=O)C)C1=C(C=C(C=C1)N=NC2=C(C(=CC=C2)[N+](=O)[O-])C#N)Cl

Isomeric SMILES

CC(=O)OCCN(CCOC(=O)C)C1=C(C=C(C=C1)N=NC2=C(C(=CC=C2)[N+](=O)[O-])C#N)Cl

InChI

InChI=1S/C21H20ClN5O6/c1-14(28)32-10-8-26(9-11-33-15(2)29)21-7-6-16(12-18(21)22)24-25-19-4-3-5-20(27(30)31)17(19)13-23/h3-7,12H,8-11H2,1-2H3