N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(phenylmethyl)sulfamoyl]benzamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(phenylmethyl)sulfamoyl]benzamide Openeye Name: 3-(benzylsulfamoyl)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-[(phenylmethyl)sulfamoyl]benzamide IUPAC Name: 3-(benzylsulfamoyl)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-(benzylsulfamoyl)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C27H32N3O4S+ MolecularWeight: 494.62568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C27H31N3O4S/c1-34-24-14-12-22(13-15-24)26(30-16-5-6-17-30)20-28-27(31)23-10-7-11-25(18-23)35(32,33)29-19-21-8-3-2-4-9-21/h2-4,7-15,18,26,29H,5-6,16-17,19-20H2,1H3,(H,28,31)/p+1/t26-/m0/s1