ethyl 4-[[4-[(3-cyanophenyl)carbamoyl]-2-nitro-phenyl]amino]butanoate

Systemtic Name: ethyl 4-[[4-[(3-cyanophenyl)carbamoyl]-2-nitro-phenyl]amino]butanoate Openeye Name: ethyl 4-[4-[(3-cyanophenyl)carbamoyl]-2-nitro-anilino]butanoate CAS Name: 4-[4-[(3-cyanoanilino)-oxomethyl]-2-nitroanilino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-cyanophenyl)carbamoyl]-2-nitroanilino]butanoate Traditional Name: 4-[4-[(3-cyanophenyl)carbamoyl]-2-nitro-anilino]butyric acid ethyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5/c1-2-29-19(25)7-4-10-22-17-9-8-15(12-18(17)24(27)28)20(26)23-16-6-3-5-14(11-16)13-21/h3,5-6,8-9,11-12,22H,2,4,7,10H2,1H3,(H,23,26)