4-bromanyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one

Systemtic Name: 4-bromanyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one Openeye Name: 4-bromo-2-[(4-nitrophenyl)methyl]phthalazin-1-one CAS Name: 4-bromo-2-[(4-nitrophenyl)methyl]-1-phthalazinone IUPAC Name: 4-bromo-2-[(4-nitrophenyl)methyl]phthalazin-1-one Traditional Name: 4-bromo-2-(4-nitrobenzyl)phthalazin-1-one Formula: C15H10BrN3O3 MolecularWeight: 360.1622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrN3O3/c16-14-12-3-1-2-4-13(12)15(20)18(17-14)9-10-5-7-11(8-6-10)19(21)22/h1-8H,9H2