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

Systemtic Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-benzyl-4-(4-isopropylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-benzyl-4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-benzyl-4-p-cumenylsulfonyl-piperazin-1-ium Formula: C20H27N2O2S+ MolecularWeight: 359.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O2S/c1-17(2)19-8-10-20(11-9-19)25(23,24)22-14-12-21(13-15-22)16-18-6-4-3-5-7-18/h3-11,17H,12-16H2,1-2H3/p+1