1-cyanoethyl 3-[(4-nitrophenyl)diazenyl]-3-phenyl-propanoate

Systemtic Name: 1-cyanoethyl 3-[(4-nitrophenyl)diazenyl]-3-phenyl-propanoate Openeye Name: 1-cyanoethyl 3-(4-nitrophenyl)azo-3-phenyl-propanoate CAS Name: 3-(4-nitrophenyl)azo-3-phenylpropanoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 3-[(4-nitrophenyl)diazenyl]-3-phenylpropanoate Traditional Name: 3-(4-nitrophenyl)azo-3-phenyl-propionic acid 1-cyanoethyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CC(C1=CC=CC=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C#N)OC(=O)CC(C1=CC=CC=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4/c1-13(12-19)26-18(23)11-17(14-5-3-2-4-6-14)21-20-15-7-9-16(10-8-15)22(24)25/h2-10,13,17H,11H2,1H3