(4-ethoxycarbonylphenyl) 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: (4-ethoxycarbonylphenyl) 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: (4-ethoxycarbonylphenyl) 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid (4-carbethoxyphenyl) ester Formula: C18H14N2O5 MolecularWeight: 338.31416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H14N2O5/c1-2-24-17(22)11-7-9-12(10-8-11)25-18(23)15-13-5-3-4-6-14(13)16(21)20-19-15/h3-10H,2H2,1H3,(H,20,21)