2-methyl-1-(3-nitrophenyl)propane-1,3-diol

Systemtic Name: 2-methyl-1-(3-nitrophenyl)propane-1,3-diol Openeye Name: 2-methyl-1-(3-nitrophenyl)propane-1,3-diol CAS Name: 2-methyl-1-(3-nitrophenyl)propane-1,3-diol IUPAC Name: 2-methyl-1-(3-nitrophenyl)propane-1,3-diol Traditional Name: 2-methyl-1-(3-nitrophenyl)propane-1,3-diol Formula: C10H13NO4 MolecularWeight: 211.21452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO4/c1-7(6-12)10(13)8-3-2-4-9(5-8)11(14)15/h2-5,7,10,12-13H,6H2,1H3