[3-(trifluoromethyl)phenyl]methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [3-(trifluoromethyl)benzyl] ester Formula: C18H13F3N2O3 MolecularWeight: 362.30263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O3/c19-18(20,21)12-5-3-4-11(8-12)10-26-16(24)9-15-13-6-1-2-7-14(13)17(25)23-22-15/h1-8H,9-10H2,(H,23,25)