[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C16H12N2O5 MolecularWeight: 312.27688

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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)O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O5/c17-8-11-3-1-2-4-12(11)18-15(21)9-23-16(22)10-5-6-13(19)14(20)7-10/h1-7,19-20H,9H2,(H,18,21)