[4-oxidanylidene-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate

Systemtic Name: [4-oxidanylidene-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate Openeye Name: [4-oxo-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-oxo-3-[4-[oxo(propoxy)methyl]phenoxy]-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-keto-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H17F3O7S MolecularWeight: 518.45849

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CS4)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CS4)C(F)(F)F

InChI

InChI=1S/C25H17F3O7S/c1-2-11-32-23(30)14-5-7-15(8-6-14)33-21-20(29)17-10-9-16(34-24(31)19-4-3-12-36-19)13-18(17)35-22(21)25(26,27)28/h3-10,12-13H,2,11H2,1H3