2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopentyl-acetamide CAS Name: 2-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylbutyl)acetamide Traditional Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isoamyl-acetamide Formula: C19H32N3O5S+ MolecularWeight: 414.53948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31N3O5S/c1-15(2)7-8-20-19(23)14-21-9-11-22(12-10-21)28(24,25)18-13-16(26-3)5-6-17(18)27-4/h5-6,13,15H,7-12,14H2,1-4H3,(H,20,23)/p+1