5-chloranyl-1-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]pyrimidin-2-one

Systemtic Name: 5-chloranyl-1-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]pyrimidin-2-one Openeye Name: 5-chloro-1-[2-(4-nitrophenyl)-2-oxo-ethyl]pyrimidin-2-one CAS Name: 5-chloro-1-[2-(4-nitrophenyl)-2-oxoethyl]-2-pyrimidinone IUPAC Name: 5-chloro-1-[2-(4-nitrophenyl)-2-oxoethyl]pyrimidin-2-one Traditional Name: 5-chloro-1-[2-keto-2-(4-nitrophenyl)ethyl]pyrimidin-2-one Formula: C12H8ClN3O4 MolecularWeight: 293.66262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CN2C=C(C=NC2=O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CN2C=C(C=NC2=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN3O4/c13-9-5-14-12(18)15(6-9)7-11(17)8-1-3-10(4-2-8)16(19)20/h1-6H,7H2