[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 4-chloranylbutanoate

Systemtic Name: [4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 4-chloranylbutanoate Openeye Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 4-chlorobutanoate CAS Name: 4-chlorobutanoic acid [4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 4-chlorobutanoate Traditional Name: 4-chlorobutyric acid [4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester Formula: C20H14ClF3O5 MolecularWeight: 426.77037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CCCCl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CCCCl)C(F)(F)F

InChI

InChI=1S/C20H14ClF3O5/c21-10-4-7-16(25)27-13-8-9-14-15(11-13)29-19(20(22,23)24)18(17(14)26)28-12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2