[2-(butylamino)-2-oxidanylidene-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C23H24N2O3 MolecularWeight: 376.44826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)C

InChI

InChI=1S/C23H24N2O3/c1-3-4-14-24-20(26)15-28-23(27)21-16(2)22(17-10-6-5-7-11-17)25-19-13-9-8-12-18(19)21/h5-13H,3-4,14-15H2,1-2H3,(H,24,26)