3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzamide Openeye Name: 3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzamide CAS Name: 3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]benzamide IUPAC Name: 3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzamide Traditional Name: 3,4-diethoxy-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzamide Formula: C24H34N3O6S+ MolecularWeight: 492.60826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)OCC

InChI

InChI=1S/C24H33N3O6S/c1-4-32-22-11-6-19(18-23(22)33-5-2)24(28)25-12-13-26-14-16-27(17-15-26)34(29,30)21-9-7-20(31-3)8-10-21/h6-11,18H,4-5,12-17H2,1-3H3,(H,25,28)/p+1