2-[2-(3-bromophenyl)-2-oxidanyl-ethyl]-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-[2-(3-bromophenyl)-2-oxidanyl-ethyl]-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-[2-(3-bromophenyl)-2-hydroxy-ethyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 2-[2-(3-bromophenyl)-2-hydroxyethyl]-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-[2-(3-bromophenyl)-2-hydroxyethyl]-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-[2-(3-bromophenyl)-2-hydroxy-ethyl]-4-(p-tolyl)phthalazin-1-one Formula: C23H19BrN2O2 MolecularWeight: 435.31316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(C4=CC(=CC=C4)Br)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(C4=CC(=CC=C4)Br)O

InChI

InChI=1S/C23H19BrN2O2/c1-15-9-11-16(12-10-15)22-19-7-2-3-8-20(19)23(28)26(25-22)14-21(27)17-5-4-6-18(24)13-17/h2-13,21,27H,14H2,1H3