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

Systemtic Name: methyl 3-(4-fluorophenyl)-2,5-dimethoxy-6-(3-oxidanyl-4-phenylmethoxy-phenyl)benzoate Openeye Name: methyl 2-(4-benzyloxy-3-hydroxy-phenyl)-5-(4-fluorophenyl)-3,6-dimethoxy-benzoate CAS Name: 5-(4-fluorophenyl)-2-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 5-(4-fluorophenyl)-2-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxybenzoate Traditional Name: 2-(4-benzoxy-3-hydroxy-phenyl)-5-(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)F)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)F)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)O

InChI

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