2-[(5-methyl-2-oxidanyl-phenyl)methyl]-4,6-dinitro-phenol

Systemtic Name: 2-[(5-methyl-2-oxidanyl-phenyl)methyl]-4,6-dinitro-phenol Openeye Name: 2-[(2-hydroxy-5-methyl-phenyl)methyl]-4,6-dinitro-phenol CAS Name: 2-[(2-hydroxy-5-methylphenyl)methyl]-4,6-dinitrophenol IUPAC Name: 2-[(2-hydroxy-5-methylphenyl)methyl]-4,6-dinitrophenol Traditional Name: 2-(2-hydroxy-5-methyl-benzyl)-4,6-dinitro-phenol Formula: C14H12N2O6 MolecularWeight: 304.25488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O6/c1-8-2-3-13(17)9(4-8)5-10-6-11(15(19)20)7-12(14(10)18)16(21)22/h2-4,6-7,17-18H,5H2,1H3