2-(6,7-dimethoxy-1-oxidanylidene-isochromen-3-yl)ethyl 4-fluoranylbenzoate

Systemtic Name: 2-(6,7-dimethoxy-1-oxidanylidene-isochromen-3-yl)ethyl 4-fluoranylbenzoate Openeye Name: 2-(6,7-dimethoxy-1-oxo-isochromen-3-yl)ethyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 2-(6,7-dimethoxy-1-oxo-2-benzopyran-3-yl)ethyl ester IUPAC Name: 2-(6,7-dimethoxy-1-oxoisochromen-3-yl)ethyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 2-(1-keto-6,7-dimethoxy-isochromen-3-yl)ethyl ester Formula: C20H17FO6 MolecularWeight: 372.343783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H17FO6/c1-24-17-10-13-9-15(27-20(23)16(13)11-18(17)25-2)7-8-26-19(22)12-3-5-14(21)6-4-12/h3-6,9-11H,7-8H2,1-2H3