octan-2-yl 2-fluoranyl-4-[2-(2-oxidanylidene-2-phenyl-ethanoyl)phenoxy]benzoate

Systemtic Name: octan-2-yl 2-fluoranyl-4-[2-(2-oxidanylidene-2-phenyl-ethanoyl)phenoxy]benzoate Openeye Name: 1-methylheptyl 2-fluoro-4-[2-(2-oxo-2-phenyl-acetyl)phenoxy]benzoate CAS Name: 4-[2-(1,2-dioxo-2-phenylethyl)phenoxy]-2-fluorobenzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 2-fluoro-4-[2-(2-oxo-2-phenylacetyl)phenoxy]benzoate Traditional Name: 2-fluoro-4-[2-(2-keto-2-phenyl-acetyl)phenoxy]benzoic acid 1-methylheptyl ester Formula: C29H29FO5 MolecularWeight: 476.535963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=C(C=C(C=C1)OC2=CC=CC=C2C(=O)C(=O)C3=CC=CC=C3)F

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=C(C=C(C=C1)OC2=CC=CC=C2C(=O)C(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C29H29FO5/c1-3-4-5-7-12-20(2)34-29(33)23-18-17-22(19-25(23)30)35-26-16-11-10-15-24(26)28(32)27(31)21-13-8-6-9-14-21/h6,8-11,13-20H,3-5,7,12H2,1-2H3