[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-(pyridin-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-(pyridin-2-ylcarbonylamino)benzoate Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl] 4-(pyridine-2-carbonylamino)benzoate CAS Name: 4-[[oxo(2-pyridinyl)methyl]amino]benzoic acid [2-(4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl] 4-(pyridine-2-carbonylamino)benzoate Traditional Name: 4-picolinamidobenzoic acid [2-(4-cyanoanilino)-2-keto-ethyl] ester Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=NC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H16N4O4/c23-13-15-4-8-17(9-5-15)25-20(27)14-30-22(29)16-6-10-18(11-7-16)26-21(28)19-3-1-2-12-24-19/h1-12H,14H2,(H,25,27)(H,26,28)