5-methyl-3,8-dinitro-dodecanoic acid

Systemtic Name: 5-methyl-3,8-dinitro-dodecanoic acid Openeye Name: 5-methyl-3,8-dinitro-dodecanoic acid CAS Name: 5-methyl-3,8-dinitrododecanoic acid IUPAC Name: 5-methyl-3,8-dinitrododecanoic acid Traditional Name: 5-methyl-3,8-dinitro-lauric acid Formula: C13H24N2O6 MolecularWeight: 304.33946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(C)CC(CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC(CCC(C)CC(CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H24N2O6/c1-3-4-5-11(14(18)19)7-6-10(2)8-12(15(20)21)9-13(16)17/h10-12H,3-9H2,1-2H3,(H,16,17)