ethanedioic acid; N-[4-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: ethanedioic acid; N-[4-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: oxalic acid; N-[4-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: oxalic acid; N-[4-[[4-[(2,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: oxalic acid; N-[4-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: oxalic acid; N-[4-[4-(2,4,5-trimethoxybenzyl)piperazino]sulfonylphenyl]acetamide Formula: C24H31N3O10S MolecularWeight: 553.58204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3OC)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3OC)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H29N3O6S.C2H2O4/c1-16(26)23-18-5-7-19(8-6-18)32(27,28)25-11-9-24(10-12-25)15-17-13-21(30-3)22(31-4)14-20(17)29-2;3-1(4)2(5)6/h5-8,13-14H,9-12,15H2,1-4H3,(H,23,26);(H,3,4)(H,5,6)