(E)-3-hexadecyl-2-methyl-henicos-2-enoate

Systemtic Name: (E)-3-hexadecyl-2-methyl-henicos-2-enoate Openeye Name: (E)-3-hexadecyl-2-methyl-henicos-2-enoate CAS Name: (E)-3-hexadecyl-2-methyl-2-heneicosenoate IUPAC Name: (E)-3-hexadecyl-2-methylhenicos-2-enoate Traditional Name: (E)-3-cetyl-2-methyl-heneicos-2-enoate Formula: C38H73O2- MolecularWeight: 561.98502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=C(C)C(=O)[O-])CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC/C(=C(\C)/C(=O)[O-])/CCCCCCCCCCCCCCCC

InChI

InChI=1S/C38H74O2/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-37(36(3)38(39)40)34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2/h4-35H2,1-3H3,(H,39,40)/p-1/b37-36+