ethanedioic acid; ethyl 4-[1-(cyclohexylmethyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethanedioic acid; ethyl 4-[1-(cyclohexylmethyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(cyclohexylmethyl)piperidine-4-carbonyl]piperazine-1-carboxylate; oxalic acid CAS Name: 4-[[1-(cyclohexylmethyl)-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4-[1-(cyclohexylmethyl)piperidine-4-carbonyl]piperazine-1-carboxylate; oxalic acid Traditional Name: 4-[1-(cyclohexylmethyl)isonipecotoyl]piperazine-1-carboxylic acid ethyl ester; oxalic acid Formula: C22H37N3O7 MolecularWeight: 455.54508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)CC3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)CC3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H35N3O3.C2H2O4/c1-2-26-20(25)23-14-12-22(13-15-23)19(24)18-8-10-21(11-9-18)16-17-6-4-3-5-7-17;3-1(4)2(5)6/h17-18H,2-16H2,1H3;(H,3,4)(H,5,6)