1-(3,4-dimethoxyphenyl)sulfonyl-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-isopropyl-piperazin-4-ium CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-isopropyl-piperazin-4-ium Formula: C15H25N2O4S+ MolecularWeight: 329.435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O4S/c1-12(2)16-7-9-17(10-8-16)22(18,19)13-5-6-14(20-3)15(11-13)21-4/h5-6,11-12H,7-10H2,1-4H3/p+1