[2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxo-ethyl] 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid [2-[(2,4-dichlorobenzyl)amino]-2-keto-ethyl] ester Formula: C29H20Cl2N2O3 MolecularWeight: 515.3867

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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=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C29H20Cl2N2O3/c30-20-13-12-19(25(31)14-20)16-32-28(34)17-36-29(35)24-15-27(33-26-11-4-3-9-23(24)26)22-10-5-7-18-6-1-2-8-21(18)22/h1-15H,16-17H2,(H,32,34)