methyl 2,4-dimethyl-5-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H23N2O3S+ MolecularWeight: 347.45182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C[NH+]2CCC[C@@H]2C3=CC=CS3

InChI

InChI=1S/C18H22N2O3S/c1-11-16(18(22)23-3)12(2)19-17(11)14(21)10-20-8-4-6-13(20)15-7-5-9-24-15/h5,7,9,13,19H,4,6,8,10H2,1-3H3/p+1/t13-/m1/s1