2-[(3-chlorophenyl)methyl]-4-pyridin-3-yl-phthalazin-1-one

Systemtic Name: 2-[(3-chlorophenyl)methyl]-4-pyridin-3-yl-phthalazin-1-one Openeye Name: 2-[(3-chlorophenyl)methyl]-4-(3-pyridyl)phthalazin-1-one CAS Name: 2-[(3-chlorophenyl)methyl]-4-(3-pyridinyl)-1-phthalazinone IUPAC Name: 2-[(3-chlorophenyl)methyl]-4-pyridin-3-ylphthalazin-1-one Traditional Name: 2-(3-chlorobenzyl)-4-(3-pyridyl)phthalazin-1-one Formula: C20H14ClN3O MolecularWeight: 347.79766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC(=CC=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC(=CC=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C20H14ClN3O/c21-16-7-3-5-14(11-16)13-24-20(25)18-9-2-1-8-17(18)19(23-24)15-6-4-10-22-12-15/h1-12H,13H2