1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylpiperazin-4-ium-1-yl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylpiperazin-4-ium-1-yl)piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylpiperazin-4-ium-1-yl)piperidine-4-carboxamide CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methyl-1-piperazin-4-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylpiperazin-4-ium-1-yl)piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylpiperazin-4-ium-1-yl)isonipecotamide Formula: C19H31N4O5S+ MolecularWeight: 427.53824

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H30N4O5S/c1-21-10-12-22(13-11-21)20-19(24)15-6-8-23(9-7-15)29(25,26)16-4-5-17(27-2)18(14-16)28-3/h4-5,14-15H,6-13H2,1-3H3,(H,20,24)/p+1