ethanedioic acid; 1-(4-methylphenyl)sulfonyl-4-propan-2-yl-piperazine

Systemtic Name: ethanedioic acid; 1-(4-methylphenyl)sulfonyl-4-propan-2-yl-piperazine Openeye Name: 1-isopropyl-4-(p-tolylsulfonyl)piperazine; oxalic acid CAS Name: 1-(4-methylphenyl)sulfonyl-4-propan-2-ylpiperazine; oxalic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-propan-2-ylpiperazine; oxalic acid Traditional Name: 1-isopropyl-4-tosyl-piperazine; oxalic acid Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H22N2O2S.C2H2O4/c1-12(2)15-8-10-16(11-9-15)19(17,18)14-6-4-13(3)5-7-14;3-1(4)2(5)6/h4-7,12H,8-11H2,1-3H3;(H,3,4)(H,5,6)