ethanedioic acid; 1-(3-methylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-(3-methylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine Openeye Name: 1-(3-methylcyclohexyl)-4-(4-pyridylmethyl)piperazine; oxalic acid CAS Name: 1-(3-methylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine; oxalic acid IUPAC Name: 1-(3-methylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine; oxalic acid Traditional Name: 1-(3-methylcyclohexyl)-4-(4-pyridylmethyl)piperazine; oxalic acid Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)N2CCN(CC2)CC3=CC=NC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1)N2CCN(CC2)CC3=CC=NC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27N3.C2H2O4/c1-15-3-2-4-17(13-15)20-11-9-19(10-12-20)14-16-5-7-18-8-6-16;3-1(4)2(5)6/h5-8,15,17H,2-4,9-14H2,1H3;(H,3,4)(H,5,6)