6-bromanyl-2-methyl-5-nitro-1-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 6-bromanyl-2-methyl-5-nitro-1-(phenylmethyl)pyrimidin-4-one Openeye Name: 1-benzyl-6-bromo-2-methyl-5-nitro-pyrimidin-4-one CAS Name: 6-bromo-2-methyl-5-nitro-1-(phenylmethyl)-4-pyrimidinone IUPAC Name: 1-benzyl-6-bromo-2-methyl-5-nitropyrimidin-4-one Traditional Name: 1-benzyl-6-bromo-2-methyl-5-nitro-pyrimidin-4-one Formula: C12H10BrN3O3 MolecularWeight: 324.1301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1CC2=CC=CC=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C(=C(N1CC2=CC=CC=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN3O3/c1-8-14-12(17)10(16(18)19)11(13)15(8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3