4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-[(2,3-dimethylphenyl)sulfamoyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C27H32N3O3S+ MolecularWeight: 478.62628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CC=C3)[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@@H](C3=CC=CC=C3)[NH+]4CCCC4)C

InChI

InChI=1S/C27H31N3O3S/c1-20-9-8-12-25(21(20)2)29-34(32,33)24-15-13-23(14-16-24)27(31)28-19-26(30-17-6-7-18-30)22-10-4-3-5-11-22/h3-5,8-16,26,29H,6-7,17-19H2,1-2H3,(H,28,31)/p+1/t26-/m0/s1