6,7-bis(oxidanyl)-3-[4-(trifluoromethyl)phenyl]chromen-2-one

Systemtic Name: 6,7-bis(oxidanyl)-3-[4-(trifluoromethyl)phenyl]chromen-2-one Openeye Name: 6,7-dihydroxy-3-[4-(trifluoromethyl)phenyl]chromen-2-one CAS Name: 6,7-dihydroxy-3-[4-(trifluoromethyl)phenyl]-1-benzopyran-2-one IUPAC Name: 6,7-dihydroxy-3-[4-(trifluoromethyl)phenyl]chromen-2-one Traditional Name: 6,7-dihydroxy-3-[4-(trifluoromethyl)phenyl]coumarin Formula: C16H9F3O4 MolecularWeight: 322.23547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=CC(=C(C=C3OC2=O)O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=CC(=C(C=C3OC2=O)O)O)C(F)(F)F

InChI

InChI=1S/C16H9F3O4/c17-16(18,19)10-3-1-8(2-4-10)11-5-9-6-12(20)13(21)7-14(9)23-15(11)22/h1-7,20-21H