(4-propoxyphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-propoxyphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-propoxyphenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (4-propoxyphenyl) ester IUPAC Name: (4-propoxyphenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (4-propoxyphenyl) ester Formula: C19H18N2O4 MolecularWeight: 338.35722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H18N2O4/c1-3-12-24-13-8-10-14(11-9-13)25-19(23)17-15-6-4-5-7-16(15)18(22)21(2)20-17/h4-11H,3,12H2,1-2H3