2-[[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]amino]benzoic acid

Systemtic Name: 2-[[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]amino]benzoic acid Openeye Name: 2-[[2-(3-cyanoanilino)-2-oxo-ethyl]amino]benzoic acid CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]amino]benzoic acid Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]amino]benzoic acid Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NCC(=O)NC2=CC=CC(=C2)C#N

InChI

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