methyl 4-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(4-oxo-3H-phthalazine-1-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-oxo-3H-phthalazine-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-3H-phthalazine-1-carbonyl)amino]benzoic acid methyl ester Formula: C17H13N3O4 MolecularWeight: 323.30282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H13N3O4/c1-24-17(23)10-6-8-11(9-7-10)18-16(22)14-12-4-2-3-5-13(12)15(21)20-19-14/h2-9H,1H3,(H,18,22)(H,20,21)