(2,3,5-triethyl-4-nitro-phenyl)methanetriol

Systemtic Name: (2,3,5-triethyl-4-nitro-phenyl)methanetriol Openeye Name: (2,3,5-triethyl-4-nitro-phenyl)methanetriol CAS Name: (2,3,5-triethyl-4-nitrophenyl)methanetriol IUPAC Name: (2,3,5-triethyl-4-nitrophenyl)methanetriol Traditional Name: (2,3,5-triethyl-4-nitro-phenyl)methanetriol Formula: C13H19NO5 MolecularWeight: 269.29366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO5/c1-4-8-7-11(13(15,16)17)9(5-2)10(6-3)12(8)14(18)19/h7,15-17H,4-6H2,1-3H3