1-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-5-chloranyl-pyrimidin-2-one

Systemtic Name: 1-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-5-chloranyl-pyrimidin-2-one Openeye Name: 5-chloro-1-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]pyrimidin-2-one CAS Name: 5-chloro-1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-2-pyrimidinone IUPAC Name: 5-chloro-1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]pyrimidin-2-one Traditional Name: 5-chloro-1-[2-(3,4-dihydroxyphenyl)-2-keto-ethyl]pyrimidin-2-one Formula: C12H9ClN2O4 MolecularWeight: 280.66386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CN2C=C(C=NC2=O)Cl)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CN2C=C(C=NC2=O)Cl)O)O

InChI

InChI=1S/C12H9ClN2O4/c13-8-4-14-12(19)15(5-8)6-11(18)7-1-2-9(16)10(17)3-7/h1-5,16-17H,6H2