(phenylmethyl) 4-[4-(4-fluorophenyl)-4-oxidanyl-cyclohexyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-(4-fluorophenyl)-4-oxidanyl-cyclohexyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[4-(4-fluorophenyl)-4-hydroxy-cyclohexyl]piperazine-1-carboxylate CAS Name: 4-[4-(4-fluorophenyl)-4-hydroxycyclohexyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(4-fluorophenyl)-4-hydroxycyclohexyl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-fluorophenyl)-4-hydroxy-cyclohexyl]piperazine-1-carboxylic acid benzyl ester Formula: C24H29FN2O3 MolecularWeight: 412.497063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCN(CC2)C(=O)OCC3=CC=CC=C3)(C4=CC=C(C=C4)F)O

Isomeric SMILES

C1CC(CCC1N2CCN(CC2)C(=O)OCC3=CC=CC=C3)(C4=CC=C(C=C4)F)O

InChI

InChI=1S/C24H29FN2O3/c25-21-8-6-20(7-9-21)24(29)12-10-22(11-13-24)26-14-16-27(17-15-26)23(28)30-18-19-4-2-1-3-5-19/h1-9,22,29H,10-18H2