(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(4-fluorophenyl)propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(4-fluorophenyl)propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-(4-fluorophenyl)propanoate CAS Name: 3-(4-fluorophenyl)propanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H19FO4 MolecularWeight: 354.371563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H19FO4/c1-13-9-18-16(11-21(24)26-19(18)10-14(13)2)12-25-20(23)8-5-15-3-6-17(22)7-4-15/h3-4,6-7,9-11H,5,8,12H2,1-2H3