4-[2,8-bis(trifluoromethyl)quinolin-4-yl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[2,8-bis(trifluoromethyl)quinolin-4-yl]-7-methoxy-chromen-2-one Openeye Name: 4-[2,8-bis(trifluoromethyl)-4-quinolyl]-7-methoxy-chromen-2-one CAS Name: 4-[2,8-bis(trifluoromethyl)-4-quinolinyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[2,8-bis(trifluoromethyl)quinolin-4-yl]-7-methoxychromen-2-one Traditional Name: 4-[2,8-bis(trifluoromethyl)-4-quinolyl]-7-methoxy-coumarin Formula: C21H11F6NO3 MolecularWeight: 439.307359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H11F6NO3/c1-30-10-5-6-11-14(9-18(29)31-16(11)7-10)13-8-17(21(25,26)27)28-19-12(13)3-2-4-15(19)20(22,23)24/h2-9H,1H3