[1-chloranyl-3-(2-methyl-5-nitro-imidazol-1-yl)propan-2-yl]oxymethyl dihydrogen phosphate

Systemtic Name: [1-chloranyl-3-(2-methyl-5-nitro-imidazol-1-yl)propan-2-yl]oxymethyl dihydrogen phosphate Openeye Name: [1-(chloromethyl)-2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]methyl dihydrogen phosphate CAS Name: [1-chloro-3-(2-methyl-5-nitro-1-imidazolyl)propan-2-yl]oxymethyl dihydrogen phosphate IUPAC Name: [1-chloro-3-(2-methyl-5-nitroimidazol-1-yl)propan-2-yl]oxymethyl dihydrogen phosphate Traditional Name: [1-(chloromethyl)-2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]methyl dihydrogen phosphate Formula: C8H13ClN3O7P MolecularWeight: 329.631481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CC(CCl)OCOP(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CC(CCl)OCOP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H13ClN3O7P/c1-6-10-3-8(12(13)14)11(6)4-7(2-9)18-5-19-20(15,16)17/h3,7H,2,4-5H2,1H3,(H2,15,16,17)