methyl 4-[5-[4-(4-cyanopiperidin-4-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]cyclohexane-1-carboxylate hydrochloride

Systemtic Name: methyl 4-[5-[4-(4-cyanopiperidin-4-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]cyclohexane-1-carboxylate hydrochloride Openeye Name: methyl 4-[5-[4-(4-cyano-4-piperidyl)phenyl]-2-oxo-imidazolidin-1-yl]cyclohexanecarboxylate hydrochloride CAS Name: 4-[5-[4-(4-cyano-4-piperidinyl)phenyl]-2-oxo-1-imidazolidinyl]-1-cyclohexanecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 4-[5-[4-(4-cyanopiperidin-4-yl)phenyl]-2-oxoimidazolidin-1-yl]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-[5-[4-(4-cyano-4-piperidyl)phenyl]-2-keto-imidazolidin-1-yl]cyclohexanecarboxylic acid methyl ester hydrochloride Formula: C23H31ClN4O3 MolecularWeight: 446.97024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)N2C(CNC2=O)C3=CC=C(C=C3)C4(CCNCC4)C#N.Cl

Isomeric SMILES

COC(=O)C1CCC(CC1)N2C(CNC2=O)C3=CC=C(C=C3)C4(CCNCC4)C#N.Cl

InChI

InChI=1S/C23H30N4O3.ClH/c1-30-21(28)17-4-8-19(9-5-17)27-20(14-26-22(27)29)16-2-6-18(7-3-16)23(15-24)10-12-25-13-11-23;/h2-3,6-7,17,19-20,25H,4-5,8-14H2,1H3,(H,26,29);1H