(4-cyanophenyl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (4-cyanophenyl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: (4-cyanophenyl)methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid (4-cyanobenzyl) ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCCC(=O)OCC2=CC=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCCC(=O)OCC2=CC=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c19-12-14-7-9-15(10-8-14)13-25-18(22)6-3-11-20-16-4-1-2-5-17(16)21(23)24/h1-2,4-5,7-10,20H,3,6,11,13H2