[2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: [2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: [2-[(3-chlorophenyl)methylamino]-2-oxo-ethyl] 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid [2-[(3-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-chlorophenyl)methylamino]-2-oxoethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid [2-[(3-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C29H21ClN2O3 MolecularWeight: 480.94164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC(=O)NCC5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC(=O)NCC5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H21ClN2O3/c30-21-10-5-7-19(15-21)17-31-28(33)18-35-29(34)25-16-27(32-26-14-4-3-12-24(25)26)23-13-6-9-20-8-1-2-11-22(20)23/h1-16H,17-18H2,(H,31,33)