6-[(3-bromophenyl)amino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[(3-bromophenyl)amino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(3-bromoanilino)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-(3-bromoanilino)-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(3-bromoanilino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(3-bromoanilino)-5-nitro-1H-pyrimidin-4-one Formula: C10H7BrN4O3 MolecularWeight: 311.09158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C(C(=O)N=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C(C(=O)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C10H7BrN4O3/c11-6-2-1-3-7(4-6)14-9-8(15(17)18)10(16)13-5-12-9/h1-5H,(H2,12,13,14,16)