4-dodecyl-2-ethoxycarbonyl-hexadecanoic acid

Systemtic Name: 4-dodecyl-2-ethoxycarbonyl-hexadecanoic acid Openeye Name: 4-dodecyl-2-ethoxycarbonyl-hexadecanoic acid CAS Name: 4-dodecyl-2-ethoxycarbonylhexadecanoic acid IUPAC Name: 4-dodecyl-2-ethoxycarbonylhexadecanoic acid Traditional Name: 2-carbethoxy-4-lauryl-palmitic acid Formula: C31H60O4 MolecularWeight: 496.8057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)CC(C(=O)O)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)CC(C(=O)O)C(=O)OCC

InChI

InChI=1S/C31H60O4/c1-4-7-9-11-13-15-17-19-21-23-25-28(27-29(30(32)33)31(34)35-6-3)26-24-22-20-18-16-14-12-10-8-5-2/h28-29H,4-27H2,1-3H3,(H,32,33)