3-[(2-azanyl-6-bromanyl-phenyl)methyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[(2-azanyl-6-bromanyl-phenyl)methyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[(2-amino-6-bromo-phenyl)methyl]-2H-phthalazine-1,4-dione CAS Name: 3-[(2-amino-6-bromophenyl)methyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[(2-amino-6-bromophenyl)methyl]-2H-phthalazine-1,4-dione Traditional Name: 3-(2-amino-6-bromo-benzyl)-2H-phthalazine-1,4-quinone Formula: C15H12BrN3O2 MolecularWeight: 346.17868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC3=C(C=CC=C3Br)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC3=C(C=CC=C3Br)N

InChI

InChI=1S/C15H12BrN3O2/c16-12-6-3-7-13(17)11(12)8-19-15(21)10-5-2-1-4-9(10)14(20)18-19/h1-7H,8,17H2,(H,18,20)