(2S)-6-methyl-4-oxidanylidene-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate

Systemtic Name: (2S)-6-methyl-4-oxidanylidene-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Openeye Name: (2S)-6-methyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate CAS Name: (2S)-6-methyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate IUPAC Name: (2S)-6-methyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Traditional Name: (2S)-4-keto-6-methyl-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH2+]C(CC2=O)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)[NH2+][C@@H](CC2=O)C(=O)[O-]

InChI

InChI=1S/C11H11NO3/c1-6-2-3-8-7(4-6)10(13)5-9(12-8)11(14)15/h2-4,9,12H,5H2,1H3,(H,14,15)/t9-/m0/s1