4-[(4-fluoranyl-2-nitro-phenyl)amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(4-fluoranyl-2-nitro-phenyl)amino]cyclohexane-1-carboxylic acid Openeye Name: 4-(4-fluoro-2-nitro-anilino)cyclohexanecarboxylic acid CAS Name: 4-(4-fluoro-2-nitroanilino)-1-cyclohexanecarboxylic acid IUPAC Name: 4-(4-fluoro-2-nitroanilino)cyclohexane-1-carboxylic acid Traditional Name: 4-(4-fluoro-2-nitro-anilino)cyclohexanecarboxylic acid Formula: C13H15FN2O4 MolecularWeight: 282.267603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1C(=O)O)NC2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C13H15FN2O4/c14-9-3-6-11(12(7-9)16(19)20)15-10-4-1-8(2-5-10)13(17)18/h3,6-8,10,15H,1-2,4-5H2,(H,17,18)