4-(4-bromophenyl)-2-(2,4-dinitrophenyl)phthalazin-1-one

Systemtic Name: 4-(4-bromophenyl)-2-(2,4-dinitrophenyl)phthalazin-1-one Openeye Name: 4-(4-bromophenyl)-2-(2,4-dinitrophenyl)phthalazin-1-one CAS Name: 4-(4-bromophenyl)-2-(2,4-dinitrophenyl)-1-phthalazinone IUPAC Name: 4-(4-bromophenyl)-2-(2,4-dinitrophenyl)phthalazin-1-one Traditional Name: 4-(4-bromophenyl)-2-(2,4-dinitrophenyl)phthalazin-1-one Formula: C20H11BrN4O5 MolecularWeight: 467.22914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H11BrN4O5/c21-13-7-5-12(6-8-13)19-15-3-1-2-4-16(15)20(26)23(22-19)17-10-9-14(24(27)28)11-18(17)25(29)30/h1-11H