1-(2,5-dimethylphenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(2,5-dimethylphenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Openeye Name: 1-(2,5-dimethylphenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(2,5-dimethylphenyl)sulfonyl-4-(1-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(2,5-dimethylphenyl)sulfonyl-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-(2,5-dimethylphenyl)sulfonyl-4-(1-naphthylmethyl)piperazin-4-ium Formula: C23H27N2O2S+ MolecularWeight: 395.53768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O2S/c1-18-10-11-19(2)23(16-18)28(26,27)25-14-12-24(13-15-25)17-21-8-5-7-20-6-3-4-9-22(20)21/h3-11,16H,12-15,17H2,1-2H3/p+1