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

Systemtic Name: [4-oxidanylidene-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] 2-fluoranylbenzoate Openeye Name: [4-oxo-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic 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] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [4-keto-3-(4-propoxycarbonylphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H18F4O7 MolecularWeight: 530.421233

Click to see the large picture

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=CC=C4F)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=CC=C4F)C(F)(F)F

InChI

InChI=1S/C27H18F4O7/c1-2-13-35-25(33)15-7-9-16(10-8-15)36-23-22(32)19-12-11-17(14-21(19)38-24(23)27(29,30)31)37-26(34)18-5-3-4-6-20(18)28/h3-12,14H,2,13H2,1H3