2-(2-methylpropyl)-2-nitro-octadecanoate

Systemtic Name: 2-(2-methylpropyl)-2-nitro-octadecanoate Openeye Name: 2-isobutyl-2-nitro-octadecanoate CAS Name: 2-(2-methylpropyl)-2-nitrooctadecanoate IUPAC Name: 2-(2-methylpropyl)-2-nitrooctadecanoate Traditional Name: 2-isobutyl-2-nitro-stearate Formula: C22H42NO4- MolecularWeight: 384.57318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(C)C)(C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(C)C)(C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H43NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(21(24)25,23(26)27)19-20(2)3/h20H,4-19H2,1-3H3,(H,24,25)/p-1