(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3-fluoranyl-4-methoxy-benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H21FO5 MolecularWeight: 384.397543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=C(C=C3)OC)F)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=C(C=C3)OC)F)C(C)C

InChI

InChI=1S/C22H21FO5/c1-12(2)16-10-17-15(9-21(24)28-20(17)7-13(16)3)11-27-22(25)14-5-6-19(26-4)18(23)8-14/h5-10,12H,11H2,1-4H3