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

Systemtic Name: cyclohexyl 2-[5-(4-azanyl-5-ethynyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]ethanoate Openeye Name: cyclohexyl 2-[5-(4-amino-5-ethynyl-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]acetate CAS Name: 2-[5-(4-amino-5-ethynyl-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[5-(4-amino-5-ethynyl-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]acetate Traditional Name: 2-[5-(4-amino-5-ethynyl-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]acetic acid cyclohexyl ester Formula: C18H23N3O6 MolecularWeight: 377.39172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN(C(=O)N=C1N)C2C(C(C(O2)CC(=O)OC3CCCCC3)O)O

Isomeric SMILES

C#CC1=CN(C(=O)N=C1N)C2C(C(C(O2)CC(=O)OC3CCCCC3)O)O

InChI

InChI=1S/C18H23N3O6/c1-2-10-9-21(18(25)20-16(10)19)17-15(24)14(23)12(27-17)8-13(22)26-11-6-4-3-5-7-11/h1,9,11-12,14-15,17,23-24H,3-8H2,(H2,19,20,25)