methyl 4-[2-oxidanylidene-3-(4-piperidin-4-ylphenyl)imidazolidin-4-yl]cyclohexane-1-carboxylate hydrochloride

Systemtic Name: methyl 4-[2-oxidanylidene-3-(4-piperidin-4-ylphenyl)imidazolidin-4-yl]cyclohexane-1-carboxylate hydrochloride Openeye Name: methyl 4-[2-oxo-3-[4-(4-piperidyl)phenyl]imidazolidin-4-yl]cyclohexanecarboxylate hydrochloride CAS Name: 4-[2-oxo-3-[4-(4-piperidinyl)phenyl]-4-imidazolidinyl]-1-cyclohexanecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 4-[2-oxo-3-(4-piperidin-4-ylphenyl)imidazolidin-4-yl]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-[2-keto-3-[4-(4-piperidyl)phenyl]imidazolidin-4-yl]cyclohexanecarboxylic acid methyl ester hydrochloride Formula: C22H32ClN3O3 MolecularWeight: 421.96078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)C2CNC(=O)N2C3=CC=C(C=C3)C4CCNCC4.Cl

Isomeric SMILES

COC(=O)C1CCC(CC1)C2CNC(=O)N2C3=CC=C(C=C3)C4CCNCC4.Cl

InChI

InChI=1S/C22H31N3O3.ClH/c1-28-21(26)18-4-2-17(3-5-18)20-14-24-22(27)25(20)19-8-6-15(7-9-19)16-10-12-23-13-11-16;/h6-9,16-18,20,23H,2-5,10-14H2,1H3,(H,24,27);1H