N-(4-chlorophenyl)-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-(4-chlorophenyl)-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-(4-chlorophenyl)-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-(4-chlorophenyl)-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-(4-chlorophenyl)-2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C22H17ClN4O2 MolecularWeight: 404.84898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=C(C=C3)Cl)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=C(C=C3)Cl)CC4=CN=CC=C4

InChI

InChI=1S/C22H17ClN4O2/c23-16-7-9-17(10-8-16)25-21(28)14-27-22(29)19-6-2-1-5-18(19)20(26-27)12-15-4-3-11-24-13-15/h1-11,13H,12,14H2,(H,25,28)