ethanedioic acid; 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methyl-piperazine

Systemtic Name: ethanedioic acid; 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methyl-piperazine Openeye Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-methyl-piperazine; oxalic acid Formula: C19H29N3O7S MolecularWeight: 443.51446

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27N3O3S.C2H2O4/c1-18-11-13-19(14-12-18)15-7-9-20(10-8-15)24(21,22)17-5-3-16(23-2)4-6-17;3-1(4)2(5)6/h3-6,15H,7-14H2,1-2H3;(H,3,4)(H,5,6)