1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Formula: C17H27N2O2S+ MolecularWeight: 323.47348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O2S/c1-14(2)7-8-18-9-11-19(12-10-18)22(20,21)17-6-5-15(3)13-16(17)4/h5-7,13H,8-12H2,1-4H3/p+1