N-(4-fluorophenyl)-4-oxidanylidene-1-[(S)-oxidanyl-(4-phenylmethoxyphenyl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(4-fluorophenyl)-4-oxidanylidene-1-[(S)-oxidanyl-(4-phenylmethoxyphenyl)methyl]cyclohexane-1-carboxamide Openeye Name: 1-[(S)-(4-benzyloxyphenyl)-hydroxy-methyl]-N-(4-fluorophenyl)-4-oxo-cyclohexanecarboxamide CAS Name: N-(4-fluorophenyl)-1-[(S)-hydroxy-(4-phenylmethoxyphenyl)methyl]-4-oxo-1-cyclohexanecarboxamide IUPAC Name: N-(4-fluorophenyl)-1-[(S)-hydroxy-(4-phenylmethoxyphenyl)methyl]-4-oxocyclohexane-1-carboxamide Traditional Name: 1-[(S)-(4-benzoxyphenyl)-hydroxy-methyl]-N-(4-fluorophenyl)-4-keto-cyclohexanecarboxamide Formula: C27H26FNO4 MolecularWeight: 447.498043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1=O)(C(C2=CC=C(C=C2)OCC3=CC=CC=C3)O)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CCC1=O)([C@H](C2=CC=C(C=C2)OCC3=CC=CC=C3)O)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C27H26FNO4/c28-21-8-10-22(11-9-21)29-26(32)27(16-14-23(30)15-17-27)25(31)20-6-12-24(13-7-20)33-18-19-4-2-1-3-5-19/h1-13,25,31H,14-18H2,(H,29,32)/t25-/m0/s1