(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[4-(trifluoromethyloxy)phenyl]prop-2-enoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[4-(trifluoromethyloxy)phenyl]prop-2-enoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl (E)-3-[4-(trifluoromethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(trifluoromethoxy)phenyl]-2-propenoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl (E)-3-[4-(trifluoromethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(trifluoromethoxy)phenyl]acrylic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H16F3NO6 MolecularWeight: 447.36075

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C=CC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)/C=C/C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C22H16F3NO6/c1-13(27)26-16-5-8-18-15(10-21(29)31-19(18)11-16)12-30-20(28)9-4-14-2-6-17(7-3-14)32-22(23,24)25/h2-11H,12H2,1H3,(H,26,27)/b9-4+