(4-cyanophenyl)methyl 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: (4-cyanophenyl)methyl 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid (4-cyanobenzyl) ester Formula: C19H15N3O3 MolecularWeight: 333.3407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15N3O3/c1-22-19(24)16-5-3-2-4-15(16)17(21-22)10-18(23)25-12-14-8-6-13(11-20)7-9-14/h2-9H,10,12H2,1H3