1-[(4-chloranyl-3-nitro-phenyl)methyl]-4,6-dimethyl-pyrimidin-2-one

Systemtic Name: 1-[(4-chloranyl-3-nitro-phenyl)methyl]-4,6-dimethyl-pyrimidin-2-one Openeye Name: 1-[(4-chloro-3-nitro-phenyl)methyl]-4,6-dimethyl-pyrimidin-2-one CAS Name: 1-[(4-chloro-3-nitrophenyl)methyl]-4,6-dimethyl-2-pyrimidinone IUPAC Name: 1-[(4-chloro-3-nitrophenyl)methyl]-4,6-dimethylpyrimidin-2-one Traditional Name: 1-(4-chloro-3-nitro-benzyl)-4,6-dimethyl-pyrimidin-2-one Formula: C13H12ClN3O3 MolecularWeight: 293.70568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClN3O3/c1-8-5-9(2)16(13(18)15-8)7-10-3-4-11(14)12(6-10)17(19)20/h3-6H,7H2,1-2H3