[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-[1-(phenylsulfonyl)piperidin-4-yl]methanone

Systemtic Name: [4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-[1-(phenylsulfonyl)piperidin-4-yl]methanone Openeye Name: [1-(benzenesulfonyl)-4-piperidyl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [1-(benzenesulfonyl)-4-piperidinyl]-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-4-yl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (1-besyl-4-piperidyl)-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone Formula: C27H32N3O3S+ MolecularWeight: 478.62628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H31N3O3S/c31-27(23-13-15-30(16-14-23)34(32,33)25-10-2-1-3-11-25)29-19-17-28(18-20-29)21-24-9-6-8-22-7-4-5-12-26(22)24/h1-12,23H,13-21H2/p+1