(2,5-dimethylphenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (2,5-dimethylbenzyl) ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H20N2O3/c1-4-22-19(23)17-8-6-5-7-16(17)18(21-22)20(24)25-12-15-11-13(2)9-10-14(15)3/h5-11H,4,12H2,1-3H3