[6-(4-chlorophenyl)carbonyl-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate

Systemtic Name: [6-(4-chlorophenyl)carbonyl-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Openeye Name: [6-(4-chlorobenzoyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate CAS Name: carbonic acid [6-[(4-chlorophenyl)-oxomethyl]-2-(trifluoromethyl)-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-(4-chlorobenzoyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Traditional Name: carbonic acid [6-(4-chlorobenzoyl)-2-(trifluoromethyl)-2H-chromen-3-yl] ester Formula: C18H10ClF3O5 MolecularWeight: 398.71721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)OC(C(=C3)OC(=O)O)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)OC(C(=C3)OC(=O)O)C(F)(F)F)Cl

InChI

InChI=1S/C18H10ClF3O5/c19-12-4-1-9(2-5-12)15(23)10-3-6-13-11(7-10)8-14(27-17(24)25)16(26-13)18(20,21)22/h1-8,16H,(H,24,25)