2-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]phthalazin-1-one

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]phthalazin-1-one Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methyl]phthalazin-1-one CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-phthalazinone IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methyl]phthalazin-1-one Traditional Name: 2-(2-bromo-4,5-dimethoxy-benzyl)phthalazin-1-one Formula: C17H15BrN2O3 MolecularWeight: 375.2166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN2C(=O)C3=CC=CC=C3C=N2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN2C(=O)C3=CC=CC=C3C=N2)Br)OC

InChI

InChI=1S/C17H15BrN2O3/c1-22-15-7-12(14(18)8-16(15)23-2)10-20-17(21)13-6-4-3-5-11(13)9-19-20/h3-9H,10H2,1-2H3