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

Systemtic Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-ethanamide Openeye Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-acetamide CAS Name: 2-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-N,N-dipropylacetamide IUPAC Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropylacetamide Traditional Name: 2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-acetamide Formula: C20H34N3O5S+ MolecularWeight: 428.56606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N3O5S/c1-5-9-22(10-6-2)20(24)16-21-11-13-23(14-12-21)29(25,26)19-15-17(27-3)7-8-18(19)28-4/h7-8,15H,5-6,9-14,16H2,1-4H3/p+1