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

Systemtic Name: 2,2-dimethyl-1-(3-nitrophenyl)propane-1,3-diol Openeye Name: 2,2-dimethyl-1-(3-nitrophenyl)propane-1,3-diol CAS Name: 2,2-dimethyl-1-(3-nitrophenyl)propane-1,3-diol IUPAC Name: 2,2-dimethyl-1-(3-nitrophenyl)propane-1,3-diol Traditional Name: 2,2-dimethyl-1-(3-nitrophenyl)propane-1,3-diol Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO4/c1-11(2,7-13)10(14)8-4-3-5-9(6-8)12(15)16/h3-6,10,13-14H,7H2,1-2H3