(4-methylphenyl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-methylphenyl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: p-tolyl 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid p-tolyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=C(C=C3)C

InChI

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