[2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)C1=CC(=O)NC2=CC=CC=C21

Isomeric SMILES

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

InChI

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