(E)-2-methyl-4-oxidanylidene-henicos-2-enoic acid

Systemtic Name: (E)-2-methyl-4-oxidanylidene-henicos-2-enoic acid Openeye Name: (E)-2-methyl-4-oxo-henicos-2-enoic acid CAS Name: (E)-2-methyl-4-oxo-2-heneicosenoic acid IUPAC Name: (E)-2-methyl-4-oxohenicos-2-enoic acid Traditional Name: (E)-4-keto-2-methyl-heneicos-2-enoic acid Formula: C22H40O3 MolecularWeight: 352.5512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C=C(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)/C=C(\C)/C(=O)O

InChI

InChI=1S/C22H40O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(23)19-20(2)22(24)25/h19H,3-18H2,1-2H3,(H,24,25)/b20-19+