butyl 2-[5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]ethanoate

Systemtic Name: butyl 2-[5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]ethanoate Openeye Name: butyl 2-[5-(4-amino-5-iodo-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]acetate CAS Name: 2-[5-(4-amino-5-iodo-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]acetic acid butyl ester IUPAC Name: butyl 2-[5-(4-amino-5-iodo-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]acetate Traditional Name: 2-[5-(4-amino-5-iodo-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]acetic acid butyl ester Formula: C14H20IN3O6 MolecularWeight: 453.22957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1C(C(C(O1)N2C=C(C(=NC2=O)N)I)O)O

Isomeric SMILES

CCCCOC(=O)CC1C(C(C(O1)N2C=C(C(=NC2=O)N)I)O)O

InChI

InChI=1S/C14H20IN3O6/c1-2-3-4-23-9(19)5-8-10(20)11(21)13(24-8)18-6-7(15)12(16)17-14(18)22/h6,8,10-11,13,20-21H,2-5H2,1H3,(H2,16,17,22)