4-bromanyl-2-[4-(2-methylphenyl)phenyl]phthalazin-1-one

Systemtic Name: 4-bromanyl-2-[4-(2-methylphenyl)phenyl]phthalazin-1-one Openeye Name: 4-bromo-2-[4-(o-tolyl)phenyl]phthalazin-1-one CAS Name: 4-bromo-2-[4-(2-methylphenyl)phenyl]-1-phthalazinone IUPAC Name: 4-bromo-2-[4-(2-methylphenyl)phenyl]phthalazin-1-one Traditional Name: 4-bromo-2-[4-(o-tolyl)phenyl]phthalazin-1-one Formula: C21H15BrN2O MolecularWeight: 391.2606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=N3)Br

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=N3)Br

InChI

InChI=1S/C21H15BrN2O/c1-14-6-2-3-7-17(14)15-10-12-16(13-11-15)24-21(25)19-9-5-4-8-18(19)20(22)23-24/h2-13H,1H3