N-methyl-3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-methyl-3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-methyl-3-[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-3-[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-methyl-3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: N-methyl-3-[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide Formula: C23H26N3O3S+ MolecularWeight: 424.53584

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O3S/c1-24-30(28,29)21-10-5-8-19(16-21)23(27)26-14-12-25(13-15-26)17-20-9-4-7-18-6-2-3-11-22(18)20/h2-11,16,24H,12-15,17H2,1H3/p+1