4-azanyl-1-[3-azido-2,2-bis(fluoranyl)-4,5-bis(oxidanyl)pentanoyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[3-azido-2,2-bis(fluoranyl)-4,5-bis(oxidanyl)pentanoyl]pyrimidin-2-one Openeye Name: 4-amino-1-(3-azido-2,2-difluoro-4,5-dihydroxy-pentanoyl)pyrimidin-2-one CAS Name: 4-amino-1-(3-azido-2,2-difluoro-4,5-dihydroxy-1-oxopentyl)-2-pyrimidinone IUPAC Name: 4-amino-1-(3-azido-2,2-difluoro-4,5-dihydroxypentanoyl)pyrimidin-2-one Traditional Name: 4-amino-1-(3-azido-2,2-difluoro-4,5-dihydroxy-pentanoyl)pyrimidin-2-one Formula: C9H10F2N6O4 MolecularWeight: 304.210306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)C(=O)C(C(C(CO)O)N=[N+]=[N-])(F)F

Isomeric SMILES

C1=CN(C(=O)N=C1N)C(=O)C(C(C(CO)O)N=[N+]=[N-])(F)F

InChI

InChI=1S/C9H10F2N6O4/c10-9(11,6(15-16-13)4(19)3-18)7(20)17-2-1-5(12)14-8(17)21/h1-2,4,6,18-19H,3H2,(H2,12,14,21)