(2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium

Systemtic Name: (2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium Openeye Name: (2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium CAS Name: (2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenylpiperazin-4-ium IUPAC Name: (2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenylpiperazin-4-ium Traditional Name: (2S)-1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium Formula: C19H25N2O4S+ MolecularWeight: 377.4778

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H24N2O4S/c1-20-11-12-21(17(14-20)15-7-5-4-6-8-15)26(22,23)16-9-10-18(24-2)19(13-16)25-3/h4-10,13,17H,11-12,14H2,1-3H3/p+1/t17-/m1/s1