methyl 2-(4-fluorophenyl)-3,6-dimethoxy-5-(3-oxidanyl-4-phenylmethoxy-phenyl)benzoate

Systemtic Name: methyl 2-(4-fluorophenyl)-3,6-dimethoxy-5-(3-oxidanyl-4-phenylmethoxy-phenyl)benzoate Openeye Name: methyl 5-(4-benzyloxy-3-hydroxy-phenyl)-2-(4-fluorophenyl)-3,6-dimethoxy-benzoate CAS Name: 2-(4-fluorophenyl)-5-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-5-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxybenzoate Traditional Name: 5-(4-benzoxy-3-hydroxy-phenyl)-2-(4-fluorophenyl)-3,6-dimethoxy-benzoic acid methyl ester Formula: C29H25FO6 MolecularWeight: 488.503603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)O)OC)C(=O)OC)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)O)OC)C(=O)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C29H25FO6/c1-33-25-16-22(20-11-14-24(23(31)15-20)36-17-18-7-5-4-6-8-18)28(34-2)27(29(32)35-3)26(25)19-9-12-21(30)13-10-19/h4-16,31H,17H2,1-3H3