ethanedioic acid; 1-(4-methylcyclohexyl)-4-methylsulfonyl-piperazine

Systemtic Name: ethanedioic acid; 1-(4-methylcyclohexyl)-4-methylsulfonyl-piperazine Openeye Name: 1-(4-methylcyclohexyl)-4-methylsulfonyl-piperazine; oxalic acid CAS Name: 1-(4-methylcyclohexyl)-4-methylsulfonylpiperazine; oxalic acid IUPAC Name: 1-(4-methylcyclohexyl)-4-methylsulfonylpiperazine; oxalic acid Traditional Name: 1-mesyl-4-(4-methylcyclohexyl)piperazine; oxalic acid Formula: C14H26N2O6S MolecularWeight: 350.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2CCN(CC2)S(=O)(=O)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCC(CC1)N2CCN(CC2)S(=O)(=O)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H24N2O2S.C2H2O4/c1-11-3-5-12(6-4-11)13-7-9-14(10-8-13)17(2,15)16;3-1(4)2(5)6/h11-12H,3-10H2,1-2H3;(H,3,4)(H,5,6)