[(2S)-1-oxidanylidene-1-[[(2S)-2-phenylbutyl]amino]propan-2-yl] quinoline-8-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[(2S)-2-phenylbutyl]amino]propan-2-yl] quinoline-8-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-[[(2S)-2-phenylbutyl]amino]ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [(2S)-1-oxo-1-[[(2S)-2-phenylbutyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[[(2S)-2-phenylbutyl]amino]propan-2-yl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [(1S)-2-keto-1-methyl-2-[[(2S)-2-phenylbutyl]amino]ethyl] ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C)OC(=O)C1=CC=CC2=C1N=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)[C@H](C)OC(=O)C1=CC=CC2=C1N=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H24N2O3/c1-3-17(18-9-5-4-6-10-18)15-25-22(26)16(2)28-23(27)20-13-7-11-19-12-8-14-24-21(19)20/h4-14,16-17H,3,15H2,1-2H3,(H,25,26)/t16-,17+/m0/s1