[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-carboxylate

Systemtic Name: [(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-carboxylate Openeye Name: [(1S)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate CAS Name: 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylic acid [(2S)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate Traditional Name: 2-keto-3,4-dihydro-1H-quinoline-6-carboxylic acid [(1S)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

C[C@@H](C(=O)N1CCCCCC1)OC(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C19H24N2O4/c1-13(18(23)21-10-4-2-3-5-11-21)25-19(24)15-6-8-16-14(12-15)7-9-17(22)20-16/h6,8,12-13H,2-5,7,9-11H2,1H3,(H,20,22)/t13-/m0/s1