(2-oxidanylidene-2-phenylazanyl-ethyl) 2-pyridin-4-ylquinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-pyridin-4-ylquinoline-4-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(4-pyridyl)quinoline-4-carboxylate CAS Name: 2-pyridin-4-yl-4-quinolinecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: 2-(4-pyridyl)cinchoninic acid (2-anilino-2-keto-ethyl) ester Formula: C23H17N3O3 MolecularWeight: 383.39938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C23H17N3O3/c27-22(25-17-6-2-1-3-7-17)15-29-23(28)19-14-21(16-10-12-24-13-11-16)26-20-9-5-4-8-18(19)20/h1-14H,15H2,(H,25,27)