dimethyl (2R)-5-(2-chlorophenyl)-2-ethanoyl-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylate

Systemtic Name: dimethyl (2R)-5-(2-chlorophenyl)-2-ethanoyl-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylate Openeye Name: dimethyl (2R)-2-acetyl-5-(2-chlorophenyl)-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylate CAS Name: (2R)-2-acetyl-5-(2-chlorophenyl)-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R)-2-acetyl-5-(2-chlorophenyl)-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylate Traditional Name: (2R)-2-acetyl-5-(2-chlorophenyl)-3,6-dimethyl-1H-pyridin-1-ium-2,4-dicarboxylic acid dimethyl ester Formula: C19H21ClNO5+ MolecularWeight: 378.82674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C([NH2+]C1(C(=O)C)C(=O)OC)C)C2=CC=CC=C2Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=C([NH2+][C@]1(C(=O)C)C(=O)OC)C)C2=CC=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C19H20ClNO5/c1-10-15(17(23)25-4)16(13-8-6-7-9-14(13)20)11(2)21-19(10,12(3)22)18(24)26-5/h6-9,21H,1-5H3/p+1/t19-/m1/s1