(2,4-dichlorophenyl)methyl 4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxylate

Systemtic Name: (2,4-dichlorophenyl)methyl 4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxylate Openeye Name: (2,4-dichlorophenyl)methyl 3-benzyl-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-(phenylmethyl)-1-phthalazinecarboxylic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl 3-benzyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-benzyl-4-keto-phthalazine-1-carboxylic acid (2,4-dichlorobenzyl) ester Formula: C23H16Cl2N2O3 MolecularWeight: 439.29074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H16Cl2N2O3/c24-17-11-10-16(20(25)12-17)14-30-23(29)21-18-8-4-5-9-19(18)22(28)27(26-21)13-15-6-2-1-3-7-15/h1-12H,13-14H2