N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,5-dimethyl-thiophene-3-carboxamide Openeye Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,5-dimethyl-thiophene-3-carboxamide CAS Name: N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2,5-dimethyl-3-thiophenecarboxamide IUPAC Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2,5-dimethylthiophene-3-carboxamide Traditional Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2,5-dimethyl-thiophene-3-carboxamide Formula: C20H27N2O2S+ MolecularWeight: 359.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)NCC(C2=CC(=CC=C2)OC)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)NC[C@@H](C2=CC(=CC=C2)OC)[NH+]3CCCC3

InChI

InChI=1S/C20H26N2O2S/c1-14-11-18(15(2)25-14)20(23)21-13-19(22-9-4-5-10-22)16-7-6-8-17(12-16)24-3/h6-8,11-12,19H,4-5,9-10,13H2,1-3H3,(H,21,23)/p+1/t19-/m0/s1