[4-(4-methylsulfanylphenyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate

Systemtic Name: [4-(4-methylsulfanylphenyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Openeye Name: [4-(4-methylsulfanylphenyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate CAS Name: carbonic acid [4-[4-(methylthio)phenyl]-2-(trifluoromethyl)-2H-1-benzopyran-3-yl] ester IUPAC Name: [4-(4-methylsulfanylphenyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Traditional Name: carbonic acid [4-[4-(methylthio)phenyl]-2-(trifluoromethyl)-2H-chromen-3-yl] ester Formula: C18H13F3O4S MolecularWeight: 382.35363

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C(F)(F)F)OC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C(F)(F)F)OC(=O)O

InChI

InChI=1S/C18H13F3O4S/c1-26-11-8-6-10(7-9-11)14-12-4-2-3-5-13(12)24-16(18(19,20)21)15(14)25-17(22)23/h2-9,16H,1H3,(H,22,23)