4-azanyl-1-[4-(hydroxymethyl)-1-oxidanyl-hexa-4,5-dien-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[4-(hydroxymethyl)-1-oxidanyl-hexa-4,5-dien-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[1,3-bis(hydroxymethyl)penta-3,4-dienyl]pyrimidin-2-one CAS Name: 4-amino-1-[1-hydroxy-4-(hydroxymethyl)hexa-4,5-dien-2-yl]-2-pyrimidinone IUPAC Name: 4-amino-1-[1-hydroxy-4-(hydroxymethyl)hexa-4,5-dien-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-(1,3-dimethylolpenta-3,4-dienyl)pyrimidin-2-one Formula: C11H15N3O3 MolecularWeight: 237.2551

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C=C(CC(CO)N1C=CC(=NC1=O)N)CO

Isomeric SMILES

C=C=C(CC(CO)N1C=CC(=NC1=O)N)CO

InChI

InChI=1S/C11H15N3O3/c1-2-8(6-15)5-9(7-16)14-4-3-10(12)13-11(14)17/h3-4,9,15-16H,1,5-7H2,(H2,12,13,17)