[(1S,2R)-2,3-bis(oxidanyl)-1-phenyl-butyl] nitrate

Systemtic Name: [(1S,2R)-2,3-bis(oxidanyl)-1-phenyl-butyl] nitrate Openeye Name: [(1S,2R)-2,3-dihydroxy-1-phenyl-butyl] nitrate CAS Name: nitric acid [(1S,2R)-2,3-dihydroxy-1-phenylbutyl] ester IUPAC Name: [(1S,2R)-2,3-dihydroxy-1-phenylbutyl] nitrate Traditional Name: nitric acid [(1S,2R)-2,3-dihydroxy-1-phenyl-butyl] ester Formula: C10H13NO5 MolecularWeight: 227.21392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C1=CC=CC=C1)O[N+](=O)[O-])O)O

Isomeric SMILES

CC([C@H]([C@H](C1=CC=CC=C1)O[N+](=O)[O-])O)O

InChI

InChI=1S/C10H13NO5/c1-7(12)9(13)10(16-11(14)15)8-5-3-2-4-6-8/h2-7,9-10,12-13H,1H3/t7?,9-,10+/m1/s1