ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine

Systemtic Name: ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine Openeye Name: 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine; oxalic acid CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine; oxalic acid IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine; oxalic acid Traditional Name: 1-(4-methoxyphenyl)sulfonyl-4-(3-methylcyclohexyl)piperazine; oxalic acid Formula: C20H30N2O7S MolecularWeight: 442.5264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H28N2O3S.C2H2O4/c1-15-4-3-5-16(14-15)19-10-12-20(13-11-19)24(21,22)18-8-6-17(23-2)7-9-18;3-1(4)2(5)6/h6-9,15-16H,3-5,10-14H2,1-2H3;(H,3,4)(H,5,6)