1-methyl-4-(2-methyl-5-propan-2-yl-phenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-methyl-4-(2-methyl-5-propan-2-yl-phenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(5-isopropyl-2-methyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-methyl-4-(2-methyl-5-propan-2-ylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-methyl-4-(2-methyl-5-propan-2-ylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(5-isopropyl-2-methyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O2S/c1-12(2)14-6-5-13(3)15(11-14)20(18,19)17-9-7-16(4)8-10-17/h5-6,11-12H,7-10H2,1-4H3/p+1