1-(3-chloranyl-4-methyl-phenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Openeye Name: 1-(3-chloro-4-methyl-phenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(3-chloro-4-methylphenyl)sulfonyl-4-(1-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(3-chloro-4-methylphenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-(3-chloro-4-methyl-phenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium Formula: C22H24ClN2O2S+ MolecularWeight: 415.95616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H23ClN2O2S/c1-17-9-10-20(15-22(17)23)28(26,27)25-13-11-24(12-14-25)16-19-7-4-6-18-5-2-3-8-21(18)19/h2-10,15H,11-14,16H2,1H3/p+1