[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] quinoline-2-carboxylate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] quinoline-2-carboxylate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] quinoline-2-carboxylate Traditional Name: quinaldic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C15H16N2O3/c1-3-16-14(18)10(2)20-15(19)13-9-8-11-6-4-5-7-12(11)17-13/h4-10H,3H2,1-2H3,(H,16,18)/t10-/m0/s1