7-chloranyl-4-(pyridin-3-ylmethyl)-2H-phthalazin-1-one

Systemtic Name: 7-chloranyl-4-(pyridin-3-ylmethyl)-2H-phthalazin-1-one Openeye Name: 7-chloro-4-(3-pyridylmethyl)-2H-phthalazin-1-one CAS Name: 7-chloro-4-(3-pyridinylmethyl)-2H-phthalazin-1-one IUPAC Name: 7-chloro-4-(pyridin-3-ylmethyl)-2H-phthalazin-1-one Traditional Name: 7-chloro-4-(3-pyridylmethyl)-2H-phthalazin-1-one Formula: C14H10ClN3O MolecularWeight: 271.7017

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=NNC(=O)C3=C2C=CC(=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)CC2=NNC(=O)C3=C2C=CC(=C3)Cl

InChI

InChI=1S/C14H10ClN3O/c15-10-3-4-11-12(7-10)14(19)18-17-13(11)6-9-2-1-5-16-8-9/h1-5,7-8H,6H2,(H,18,19)