2-(2-methyl-4-nitro-phenyl)propane-1,3-diol

Systemtic Name: 2-(2-methyl-4-nitro-phenyl)propane-1,3-diol Openeye Name: 2-(2-methyl-4-nitro-phenyl)propane-1,3-diol CAS Name: 2-(2-methyl-4-nitrophenyl)propane-1,3-diol IUPAC Name: 2-(2-methyl-4-nitrophenyl)propane-1,3-diol Traditional Name: 2-(2-methyl-4-nitro-phenyl)propane-1,3-diol Formula: C10H13NO4 MolecularWeight: 211.21452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C(CO)CO

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C(CO)CO

InChI

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