[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: [2-(2-benzoylanilino)-2-oxo-ethyl] 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: 2-(3-pyridinyl)-4-quinolinecarboxylic acid [2-(2-benzoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylanilino)-2-oxoethyl] 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: 2-(3-pyridyl)cinchoninic acid [2-(2-benzoylanilino)-2-keto-ethyl] ester Formula: C30H21N3O4 MolecularWeight: 487.50544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C30H21N3O4/c34-28(33-26-15-7-5-13-23(26)29(35)20-9-2-1-3-10-20)19-37-30(36)24-17-27(21-11-8-16-31-18-21)32-25-14-6-4-12-22(24)25/h1-18H,19H2,(H,33,34)