4-azanyl-2-nitro-cyclohexane-1-carboxylic acid

Systemtic Name: 4-azanyl-2-nitro-cyclohexane-1-carboxylic acid Openeye Name: 4-amino-2-nitro-cyclohexanecarboxylic acid CAS Name: 4-amino-2-nitro-1-cyclohexanecarboxylic acid IUPAC Name: 4-amino-2-nitrocyclohexane-1-carboxylic acid Traditional Name: 4-amino-2-nitro-cyclohexanecarboxylic acid Formula: C7H12N2O4 MolecularWeight: 188.18118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1N)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC(C(CC1N)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C7H12N2O4/c8-4-1-2-5(7(10)11)6(3-4)9(12)13/h4-6H,1-3,8H2,(H,10,11)