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

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(4-chlorophenyl)sulfonyl-4-(1-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium Formula: C21H22ClN2O2S+ MolecularWeight: 401.92958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O2S/c22-19-8-10-20(11-9-19)27(25,26)24-14-12-23(13-15-24)16-18-6-3-5-17-4-1-2-7-21(17)18/h1-11H,12-16H2/p+1