4-oxidanylidenebutyl 1-(1,2,4-triazol-1-yl)butan-2-yloxy phosphate

Systemtic Name: 4-oxidanylidenebutyl 1-(1,2,4-triazol-1-yl)butan-2-yloxy phosphate Openeye Name: 4-oxobutyl 1-(1,2,4-triazol-1-ylmethyl)propoxy phosphate CAS Name: 4-oxobutyl 1-(1,2,4-triazol-1-yl)butan-2-yloxy phosphate IUPAC Name: 4-oxobutyl 1-(1,2,4-triazol-1-yl)butan-2-yloxy phosphate Traditional Name: 4-ketobutyl 1-(1,2,4-triazol-1-ylmethyl)propoxy phosphate Formula: C10H17N3O6P- MolecularWeight: 306.232241

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C=NC=N1)OOP(=O)([O-])OCCCC=O

Isomeric SMILES

CCC(CN1C=NC=N1)OOP(=O)([O-])OCCCC=O

InChI

InChI=1S/C10H18N3O6P/c1-2-10(7-13-9-11-8-12-13)18-19-20(15,16)17-6-4-3-5-14/h5,8-10H,2-4,6-7H2,1H3,(H,15,16)/p-1