[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-azanylbenzoate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-azanylbenzoate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)COC(=O)C2=CC=C(C=C2)N

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)COC(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H13N3O3/c17-9-12-3-1-2-4-14(12)19-15(20)10-22-16(21)11-5-7-13(18)8-6-11/h1-8H,10,18H2,(H,19,20)