2-nitro-4-[1-(3-nitro-4-oxidanyl-phenyl)cyclohexyl]phenol

Systemtic Name: 2-nitro-4-[1-(3-nitro-4-oxidanyl-phenyl)cyclohexyl]phenol Openeye Name: 4-[1-(4-hydroxy-3-nitro-phenyl)cyclohexyl]-2-nitro-phenol CAS Name: 4-[1-(4-hydroxy-3-nitrophenyl)cyclohexyl]-2-nitrophenol IUPAC Name: 4-[1-(4-hydroxy-3-nitrophenyl)cyclohexyl]-2-nitrophenol Traditional Name: 4-[1-(4-hydroxy-3-nitro-phenyl)cyclohexyl]-2-nitro-phenol Formula: C18H18N2O6 MolecularWeight: 358.34532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC(=C(C=C2)O)[N+](=O)[O-])C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)(C2=CC(=C(C=C2)O)[N+](=O)[O-])C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6/c21-16-6-4-12(10-14(16)19(23)24)18(8-2-1-3-9-18)13-5-7-17(22)15(11-13)20(25)26/h4-7,10-11,21-22H,1-3,8-9H2