ethanedioic acid; 1-(4-methylphenyl)sulfonyl-4-(1-propylpiperidin-4-yl)piperazine

Systemtic Name: ethanedioic acid; 1-(4-methylphenyl)sulfonyl-4-(1-propylpiperidin-4-yl)piperazine Openeye Name: oxalic acid; 1-(1-propyl-4-piperidyl)-4-(p-tolylsulfonyl)piperazine CAS Name: 1-(4-methylphenyl)sulfonyl-4-(1-propyl-4-piperidinyl)piperazine; oxalic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-(1-propylpiperidin-4-yl)piperazine; oxalic acid Traditional Name: oxalic acid; 1-(1-propyl-4-piperidyl)-4-tosyl-piperazine Formula: C21H33N3O6S MolecularWeight: 455.56822

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN1CCC(CC1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31N3O2S.C2H2O4/c1-3-10-20-11-8-18(9-12-20)21-13-15-22(16-14-21)25(23,24)19-6-4-17(2)5-7-19;3-1(4)2(5)6/h4-7,18H,3,8-16H2,1-2H3;(H,3,4)(H,5,6)