[3-(3-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] methanesulfonate

Systemtic Name: [3-(3-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] methanesulfonate Openeye Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] methanesulfonate CAS Name: methanesulfonic acid [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-keto-3-(3-methoxyphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C18H13F3O7S MolecularWeight: 430.35183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C18H13F3O7S/c1-25-10-4-3-5-11(8-10)26-16-15(22)13-7-6-12(28-29(2,23)24)9-14(13)27-17(16)18(19,20)21/h3-9H,1-2H3