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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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