2-dimethoxyphosphoryl-1-nitro-4-phenyl-butan-2-ol

Systemtic Name: 2-dimethoxyphosphoryl-1-nitro-4-phenyl-butan-2-ol Openeye Name: 2-dimethoxyphosphoryl-1-nitro-4-phenyl-butan-2-ol CAS Name: 2-dimethoxyphosphoryl-1-nitro-4-phenyl-2-butanol IUPAC Name: 2-dimethoxyphosphoryl-1-nitro-4-phenylbutan-2-ol Traditional Name: 2-dimethoxyphosphoryl-1-nitro-4-phenyl-butan-2-ol Formula: C12H18NO6P MolecularWeight: 303.248181

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C(CCC1=CC=CC=C1)(C[N+](=O)[O-])O)OC

Isomeric SMILES

COP(=O)(C(CCC1=CC=CC=C1)(C[N+](=O)[O-])O)OC

InChI

InChI=1S/C12H18NO6P/c1-18-20(17,19-2)12(14,10-13(15)16)9-8-11-6-4-3-5-7-11/h3-7,14H,8-10H2,1-2H3