12-nitro-9-oxidanylidene-dodecanoic acid

Systemtic Name: 12-nitro-9-oxidanylidene-dodecanoic acid Openeye Name: 12-nitro-9-oxo-dodecanoic acid CAS Name: 12-nitro-9-oxododecanoic acid IUPAC Name: 12-nitro-9-oxododecanoic acid Traditional Name: 9-keto-12-nitro-lauric acid Formula: C12H21NO5 MolecularWeight: 259.29884

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC(=O)CCC[N+](=O)[O-])CCCC(=O)O

Isomeric SMILES

C(CCCC(=O)CCC[N+](=O)[O-])CCCC(=O)O

InChI

InChI=1S/C12H21NO5/c14-11(8-6-10-13(17)18)7-4-2-1-3-5-9-12(15)16/h1-10H2,(H,15,16)