(2S)-4-methyl-2-phenyl-1-(4-propan-2-ylphenyl)sulfonyl-piperazin-4-ium

Systemtic Name: (2S)-4-methyl-2-phenyl-1-(4-propan-2-ylphenyl)sulfonyl-piperazin-4-ium Openeye Name: (2S)-1-(4-isopropylphenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium CAS Name: (2S)-4-methyl-2-phenyl-1-(4-propan-2-ylphenyl)sulfonylpiperazin-4-ium IUPAC Name: (2S)-4-methyl-2-phenyl-1-(4-propan-2-ylphenyl)sulfonylpiperazin-4-ium Traditional Name: (2S)-4-methyl-1-p-cumenylsulfonyl-2-phenyl-piperazin-4-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+](CC2C3=CC=CC=C3)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](C[C@@H]2C3=CC=CC=C3)C

InChI

InChI=1S/C20H26N2O2S/c1-16(2)17-9-11-19(12-10-17)25(23,24)22-14-13-21(3)15-20(22)18-7-5-4-6-8-18/h4-12,16,20H,13-15H2,1-3H3/p+1/t20-/m1/s1