(phenylmethyl) 4-(piperazin-1-ylcarbonylamino)cyclohexane-1-carboxylate dihydrochloride

Systemtic Name: (phenylmethyl) 4-(piperazin-1-ylcarbonylamino)cyclohexane-1-carboxylate dihydrochloride Openeye Name: benzyl 4-(piperazine-1-carbonylamino)cyclohexanecarboxylate dihydrochloride CAS Name: 4-[[oxo(1-piperazinyl)methyl]amino]-1-cyclohexanecarboxylic acid (phenylmethyl) ester dihydrochloride IUPAC Name: benzyl 4-(piperazine-1-carbonylamino)cyclohexane-1-carboxylate dihydrochloride Traditional Name: 4-(piperazine-1-carbonylamino)cyclohexanecarboxylic acid benzyl ester dihydrochloride Formula: C19H29Cl2N3O3 MolecularWeight: 418.35786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)OCC2=CC=CC=C2)NC(=O)N3CCNCC3.Cl.Cl

Isomeric SMILES

C1CC(CCC1C(=O)OCC2=CC=CC=C2)NC(=O)N3CCNCC3.Cl.Cl

InChI

InChI=1S/C19H27N3O3.2ClH/c23-18(25-14-15-4-2-1-3-5-15)16-6-8-17(9-7-16)21-19(24)22-12-10-20-11-13-22;;/h1-5,16-17,20H,6-14H2,(H,21,24);2*1H