2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one CAS Name: 2-[2-(4-bromophenyl)-2-oxoethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one Traditional Name: 2-[2-(4-bromophenyl)-2-keto-ethyl]-4-phenyl-5,6,7,8-tetrahydrophthalazin-1-one Formula: C22H19BrN2O2 MolecularWeight: 423.30246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN(C2=O)CC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NN(C2=O)CC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H19BrN2O2/c23-17-12-10-15(11-13-17)20(26)14-25-22(27)19-9-5-4-8-18(19)21(24-25)16-6-2-1-3-7-16/h1-3,6-7,10-13H,4-5,8-9,14H2