6-ethyl-7-oxidanyl-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]chromen-2-one

Systemtic Name: 6-ethyl-7-oxidanyl-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[2-[4-(trifluoromethyl)phenyl]ethylamino]methyl]coumarin Formula: C21H20F3NO3 MolecularWeight: 391.38361

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCCC3=CC=C(C=C3)C(F)(F)F)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCCC3=CC=C(C=C3)C(F)(F)F)O

InChI

InChI=1S/C21H20F3NO3/c1-2-14-9-17-15(10-20(27)28-19(17)11-18(14)26)12-25-8-7-13-3-5-16(6-4-13)21(22,23)24/h3-6,9-11,25-26H,2,7-8,12H2,1H3