(2R)-7,8-dimethyl-4-oxidanylidene-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate

Systemtic Name: (2R)-7,8-dimethyl-4-oxidanylidene-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Openeye Name: (2R)-7,8-dimethyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate CAS Name: (2R)-7,8-dimethyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate IUPAC Name: (2R)-7,8-dimethyl-4-oxo-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Traditional Name: (2R)-4-keto-7,8-dimethyl-2,3-dihydro-1H-quinolin-1-ium-2-carboxylate Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)CC([NH2+]2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C[C@@H]([NH2+]2)C(=O)[O-])C

InChI

InChI=1S/C12H13NO3/c1-6-3-4-8-10(14)5-9(12(15)16)13-11(8)7(6)2/h3-4,9,13H,5H2,1-2H3,(H,15,16)/t9-/m1/s1