(3,4-dichlorophenyl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: (3,4-dichlorophenyl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: (3,4-dichlorophenyl)methyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid (3,4-dichlorobenzyl) ester Formula: C16H10Cl2N2O3 MolecularWeight: 349.1682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H10Cl2N2O3/c17-12-6-5-9(7-13(12)18)8-23-16(22)14-10-3-1-2-4-11(10)15(21)20-19-14/h1-7H,8H2,(H,20,21)