1-(naphthalen-1-ylmethyl)-4-(phenylmethyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(naphthalen-1-ylmethyl)-4-(phenylmethyl)sulfonyl-piperazin-1-ium Openeye Name: 1-benzylsulfonyl-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(1-naphthalenylmethyl)-4-(phenylmethyl)sulfonylpiperazin-1-ium IUPAC Name: 1-benzylsulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-benzylsulfonyl-4-(1-naphthylmethyl)piperazin-4-ium Formula: C22H25N2O2S+ MolecularWeight: 381.5111

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O2S/c25-27(26,18-19-7-2-1-3-8-19)24-15-13-23(14-16-24)17-21-11-6-10-20-9-4-5-12-22(20)21/h1-12H,13-18H2/p+1