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

Systemtic Name: 1-(2,5-dimethylphenyl)sulfonyl-4-propyl-piperazin-4-ium Openeye Name: 1-(2,5-dimethylphenyl)sulfonyl-4-propyl-piperazin-4-ium CAS Name: 1-(2,5-dimethylphenyl)sulfonyl-4-propylpiperazin-4-ium IUPAC Name: 1-(2,5-dimethylphenyl)sulfonyl-4-propylpiperazin-4-ium Traditional Name: 1-(2,5-dimethylphenyl)sulfonyl-4-propyl-piperazin-4-ium Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

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