2-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(2-cyanoethyl)amino]ethyl ethanoate

Systemtic Name: 2-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(2-cyanoethyl)amino]ethyl ethanoate Openeye Name: 2-[4-(2-chloro-4-nitro-phenyl)azo-N-(2-cyanoethyl)anilino]ethyl acetate CAS Name: acetic acid 2-[4-(2-chloro-4-nitrophenyl)azo-N-(2-cyanoethyl)anilino]ethyl ester IUPAC Name: 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(2-cyanoethyl)anilino]ethyl acetate Traditional Name: acetic acid 2-[4-(2-chloro-4-nitro-phenyl)azo-N-(2-cyanoethyl)anilino]ethyl ester Formula: C19H18ClN5O4 MolecularWeight: 415.83032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN5O4/c1-14(26)29-12-11-24(10-2-9-21)16-5-3-15(4-6-16)22-23-19-8-7-17(25(27)28)13-18(19)20/h3-8,13H,2,10-12H2,1H3