5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]chromen-2-one

Systemtic Name: 5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]chromen-2-one Openeye Name: 5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]chromen-2-one CAS Name: 5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]-1-benzopyran-2-one IUPAC Name: 5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]chromen-2-one Traditional Name: 5,6,7-trimethoxy-4-[4-[4-(trifluoromethyl)phenyl]phenyl]coumarin Formula: C25H19F3O5 MolecularWeight: 456.41057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)C4=CC=C(C=C4)C(F)(F)F)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)C4=CC=C(C=C4)C(F)(F)F)OC)OC

InChI

InChI=1S/C25H19F3O5/c1-30-20-13-19-22(24(32-3)23(20)31-2)18(12-21(29)33-19)16-6-4-14(5-7-16)15-8-10-17(11-9-15)25(26,27)28/h4-13H,1-3H3