4-(phenylsulfonylamino)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(phenylsulfonylamino)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(benzenesulfonamido)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-(benzenesulfonamido)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(benzenesulfonamido)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(benzenesulfonamido)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C26H30N3O3S+ MolecularWeight: 464.5997

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c30-26(27-19-21-9-11-22(12-10-21)20-29-17-5-2-6-18-29)23-13-15-24(16-14-23)28-33(31,32)25-7-3-1-4-8-25/h1,3-4,7-16,28H,2,5-6,17-20H2,(H,27,30)/p+1