(2R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: (2R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: (2R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: (2R)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: (2R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: (2R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydrobenzothiophene-2-carboxamide Formula: C22H27N2O2S+ MolecularWeight: 383.52698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2CC3=CC=CC=C3S2)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1[C@H](CNC(=O)[C@H]2CC3=CC=CC=C3S2)[NH+]4CCCC4

InChI

InChI=1S/C22H26N2O2S/c1-26-19-10-4-3-9-17(19)18(24-12-6-7-13-24)15-23-22(25)21-14-16-8-2-5-11-20(16)27-21/h2-5,8-11,18,21H,6-7,12-15H2,1H3,(H,23,25)/p+1/t18-,21+/m0/s1