4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phthalazin-1-one

Systemtic Name: 4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phthalazin-1-one Openeye Name: 4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phthalazin-1-one CAS Name: 4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-phthalazinone IUPAC Name: 4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phthalazin-1-one Traditional Name: 4-(4-bromophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phthalazin-1-one Formula: C24H20BrN3O MolecularWeight: 446.3391

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C24H20BrN3O/c25-20-11-9-18(10-12-20)23-21-7-3-4-8-22(21)24(29)28(26-23)16-27-14-13-17-5-1-2-6-19(17)15-27/h1-12H,13-16H2