cyclohexyl 4-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: cyclohexyl 4-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperazine-1-carboxylate hydrochloride Openeye Name: cyclohexyl 4-[4-(4-fluorophenyl)-4-oxo-butyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[4-(4-fluorophenyl)-4-oxobutyl]-1-piperazinecarboxylic acid cyclohexyl ester hydrochloride IUPAC Name: cyclohexyl 4-[4-(4-fluorophenyl)-4-oxobutyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[4-(4-fluorophenyl)-4-keto-butyl]piperazine-1-carboxylic acid cyclohexyl ester hydrochloride Formula: C21H30ClFN2O3 MolecularWeight: 412.925903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C21H29FN2O3.ClH/c22-18-10-8-17(9-11-18)20(25)7-4-12-23-13-15-24(16-14-23)21(26)27-19-5-2-1-3-6-19;/h8-11,19H,1-7,12-16H2;1H