2-[4-(aminomethyl)phthalazin-1-yl]ethanoyl 3-(trifluoromethyl)benzoate

Systemtic Name: 2-[4-(aminomethyl)phthalazin-1-yl]ethanoyl 3-(trifluoromethyl)benzoate Openeye Name: [2-[4-(aminomethyl)phthalazin-1-yl]acetyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [2-[4-(aminomethyl)-1-phthalazinyl]-1-oxoethyl] ester IUPAC Name: [2-[4-(aminomethyl)phthalazin-1-yl]acetyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [2-[4-(aminomethyl)phthalazin-1-yl]acetyl] ester Formula: C19H14F3N3O3 MolecularWeight: 389.32797

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2CN)CC(=O)OC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2CN)CC(=O)OC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H14F3N3O3/c20-19(21,22)12-5-3-4-11(8-12)18(27)28-17(26)9-15-13-6-1-2-7-14(13)16(10-23)25-24-15/h1-8H,9-10,23H2