[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-phenylquinoline-4-carboxylate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-phenylquinoline-4-carboxylate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C25H19ClN2O3 MolecularWeight: 430.88296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H19ClN2O3/c26-19-12-10-17(11-13-19)15-27-24(29)16-31-25(30)21-14-23(18-6-2-1-3-7-18)28-22-9-5-4-8-20(21)22/h1-14H,15-16H2,(H,27,29)