[5-(5-azanyl-4-cyano-imidazol-1-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate

Systemtic Name: [5-(5-azanyl-4-cyano-imidazol-1-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate Openeye Name: [5-(5-amino-4-cyano-imidazol-1-yl)-3,4-di(propanoyloxy)tetrahydrofuran-2-yl]methyl propanoate CAS Name: propanoic acid [5-(5-amino-4-cyano-1-imidazolyl)-3,4-bis(1-oxopropoxy)-2-oxolanyl]methyl ester IUPAC Name: [5-(5-amino-4-cyanoimidazol-1-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate Traditional Name: propionic acid [5-(5-amino-4-cyano-imidazol-1-yl)-3,4-dipropionyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C18H24N4O7 MolecularWeight: 408.40576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1C(C(C(O1)N2C=NC(=C2N)C#N)OC(=O)CC)OC(=O)CC

Isomeric SMILES

CCC(=O)OCC1C(C(C(O1)N2C=NC(=C2N)C#N)OC(=O)CC)OC(=O)CC

InChI

InChI=1S/C18H24N4O7/c1-4-12(23)26-8-11-15(28-13(24)5-2)16(29-14(25)6-3)18(27-11)22-9-21-10(7-19)17(22)20/h9,11,15-16,18H,4-6,8,20H2,1-3H3