3-(2,3-dihydroindol-1-ylsulfonyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Openeye Name: 3-indolin-1-ylsulfonyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide CAS Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Traditional Name: 3-indolin-1-ylsulfonyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Formula: C21H26N3O3S+ MolecularWeight: 400.51444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H25N3O3S/c25-21(22-11-15-23-12-3-4-13-23)18-7-5-8-19(16-18)28(26,27)24-14-10-17-6-1-2-9-20(17)24/h1-2,5-9,16H,3-4,10-15H2,(H,22,25)/p+1