4-methoxy-N-[[3-[3-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[[3-[3-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[[3-[3-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]benzenesulfonamide CAS Name: 4-methoxy-N-[[3-[3-[(1-methyl-1-piperidin-1-iumyl)methyl]phenyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[[3-[3-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[3-[3-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]benzyl]benzenesulfonamide Formula: C27H33N2O3S+ MolecularWeight: 465.62752

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNS(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

C[N+]1(CCCCC1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNS(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H33N2O3S/c1-29(16-4-3-5-17-29)21-23-9-7-11-25(19-23)24-10-6-8-22(18-24)20-28-33(30,31)27-14-12-26(32-2)13-15-27/h6-15,18-19,28H,3-5,16-17,20-21H2,1-2H3/q+1