[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)C

InChI

InChI=1S/C24H26N2O3/c1-4-10-16(2)25-21(27)15-29-24(28)22-17(3)23(18-11-6-5-7-12-18)26-20-14-9-8-13-19(20)22/h5-9,11-14,16H,4,10,15H2,1-3H3,(H,25,27)/t16-/m0/s1