3-(2,3-dihydroindol-1-ylsulfonyl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Openeye Name: 3-indolin-1-ylsulfonyl-N-(3-piperidin-1-ium-1-ylpropyl)benzamide CAS Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-[3-(1-piperidin-1-iumyl)propyl]benzamide IUPAC Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Traditional Name: 3-indolin-1-ylsulfonyl-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C23H29N3O3S/c27-23(24-13-7-16-25-14-4-1-5-15-25)20-9-6-10-21(18-20)30(28,29)26-17-12-19-8-2-3-11-22(19)26/h2-3,6,8-11,18H,1,4-5,7,12-17H2,(H,24,27)/p+1