pyridin-2-ylmethyl 4-(piperazin-1-ylcarbonylamino)cyclohexane-1-carboxylate dihydrochloride

Systemtic Name: pyridin-2-ylmethyl 4-(piperazin-1-ylcarbonylamino)cyclohexane-1-carboxylate dihydrochloride Openeye Name: 2-pyridylmethyl 4-(piperazine-1-carbonylamino)cyclohexanecarboxylate dihydrochloride CAS Name: 4-[[oxo(1-piperazinyl)methyl]amino]-1-cyclohexanecarboxylic acid 2-pyridinylmethyl ester dihydrochloride IUPAC Name: pyridin-2-ylmethyl 4-(piperazine-1-carbonylamino)cyclohexane-1-carboxylate dihydrochloride Traditional Name: 4-(piperazine-1-carbonylamino)cyclohexanecarboxylic acid 2-pyridylmethyl ester dihydrochloride Formula: C18H28Cl2N4O3 MolecularWeight: 419.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)OCC2=CC=CC=N2)NC(=O)N3CCNCC3.Cl.Cl

Isomeric SMILES

C1CC(CCC1C(=O)OCC2=CC=CC=N2)NC(=O)N3CCNCC3.Cl.Cl

InChI

InChI=1S/C18H26N4O3.2ClH/c23-17(25-13-16-3-1-2-8-20-16)14-4-6-15(7-5-14)21-18(24)22-11-9-19-10-12-22;;/h1-3,8,14-15,19H,4-7,9-13H2,(H,21,24);2*1H