4-(phenylsulfonylamino)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-(phenylsulfonylamino)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-(benzenesulfonamido)-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-(benzenesulfonamido)-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-(benzenesulfonamido)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-(benzenesulfonamido)-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-16(2)24-14-12-18(13-15-24)22-21(25)17-8-10-19(11-9-17)23-28(26,27)20-6-4-3-5-7-20/h3-11,16,18,23H,12-15H2,1-2H3,(H,22,25)/p+1