methyl 4-[3-(1-piperidin-4-ylimidazol-4-yl)propanoylamino]cyclohexane-1-carboxylate dihydrochloride

Systemtic Name: methyl 4-[3-(1-piperidin-4-ylimidazol-4-yl)propanoylamino]cyclohexane-1-carboxylate dihydrochloride Openeye Name: methyl 4-[3-[1-(4-piperidyl)imidazol-4-yl]propanoylamino]cyclohexanecarboxylate dihydrochloride CAS Name: 4-[[1-oxo-3-[1-(4-piperidinyl)-4-imidazolyl]propyl]amino]-1-cyclohexanecarboxylic acid methyl ester dihydrochloride IUPAC Name: methyl 4-[3-(1-piperidin-4-ylimidazol-4-yl)propanoylamino]cyclohexane-1-carboxylate dihydrochloride Traditional Name: 4-[3-[1-(4-piperidyl)imidazol-4-yl]propanoylamino]cyclohexanecarboxylic acid methyl ester dihydrochloride Formula: C19H32Cl2N4O3 MolecularWeight: 435.38838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)NC(=O)CCC2=CN(C=N2)C3CCNCC3.Cl.Cl

Isomeric SMILES

COC(=O)C1CCC(CC1)NC(=O)CCC2=CN(C=N2)C3CCNCC3.Cl.Cl

InChI

InChI=1S/C19H30N4O3.2ClH/c1-26-19(25)14-2-4-15(5-3-14)22-18(24)7-6-16-12-23(13-21-16)17-8-10-20-11-9-17;;/h12-15,17,20H,2-11H2,1H3,(H,22,24);2*1H