methyl 5-[(2R)-2-(2,3-dimethylpyridin-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(2R)-2-(2,3-dimethylpyridin-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(2R)-2-(2,3-dimethylpyridin-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2R)-2-(2,3-dimethyl-1-pyridin-1-iumyl)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2R)-2-(2,3-dimethylpyridin-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2R)-2-(2,3-dimethylpyridin-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)C(C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C)C

Isomeric SMILES

CC1=C([N+](=CC=C1)[C@H](C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C)C

InChI

InChI=1S/C18H22N2O3/c1-10-8-7-9-20(13(10)4)14(5)17(21)16-11(2)15(12(3)19-16)18(22)23-6/h7-9,14H,1-6H3/p+1/t14-/m1/s1