[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C24H25ClN2O3 MolecularWeight: 424.9199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C24H25ClN2O3/c1-4-8-15(2)26-21(28)14-30-24(29)22-16(3)23(17-9-7-10-18(25)13-17)27-20-12-6-5-11-19(20)22/h5-7,9-13,15H,4,8,14H2,1-3H3,(H,26,28)