[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-pyridin-4-ylquinoline-4-carboxylate

Systemtic Name: [2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-pyridin-4-ylquinoline-4-carboxylate Openeye Name: [2-(3,4-dichlorophenyl)-2-oxo-ethyl] 2-(4-pyridyl)quinoline-4-carboxylate CAS Name: 2-pyridin-4-yl-4-quinolinecarboxylic acid [2-(3,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-2-oxoethyl] 2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: 2-(4-pyridyl)cinchoninic acid [2-(3,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C23H14Cl2N2O3 MolecularWeight: 437.27486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H14Cl2N2O3/c24-18-6-5-15(11-19(18)25)22(28)13-30-23(29)17-12-21(14-7-9-26-10-8-14)27-20-4-2-1-3-16(17)20/h1-12H,13H2