1-(4-propan-2-ylphenyl)sulfonyl-4-propyl-piperazin-4-ium

Systemtic Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-propyl-piperazin-4-ium Openeye Name: 1-(4-isopropylphenyl)sulfonyl-4-propyl-piperazin-4-ium CAS Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-propylpiperazin-4-ium IUPAC Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-propylpiperazin-4-ium Traditional Name: 1-p-cumenylsulfonyl-4-propyl-piperazin-4-ium Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2S/c1-4-9-17-10-12-18(13-11-17)21(19,20)16-7-5-15(6-8-16)14(2)3/h5-8,14H,4,9-13H2,1-3H3/p+1