2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)COCC2=NC3=CC=CC=C3S2)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1[C@H](CNC(=O)COCC2=NC3=CC=CC=C3S2)[NH+]4CCCC4

InChI

InChI=1S/C23H27N3O3S/c1-28-20-10-4-2-8-17(20)19(26-12-6-7-13-26)14-24-22(27)15-29-16-23-25-18-9-3-5-11-21(18)30-23/h2-5,8-11,19H,6-7,12-16H2,1H3,(H,24,27)/p+1/t19-/m0/s1