(E)-4-oxidanylidene-4-tridecan-6-yloxy-but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-tridecan-6-yloxy-but-2-enoic acid Openeye Name: (E)-4-oxo-4-(1-pentyloctoxy)but-2-enoic acid CAS Name: (E)-4-oxo-4-tridecan-6-yloxy-2-butenoic acid IUPAC Name: (E)-4-oxo-4-tridecan-6-yloxybut-2-enoic acid Traditional Name: (E)-4-(1-amyloctoxy)-4-keto-but-2-enoic acid Formula: C17H30O4 MolecularWeight: 298.4177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCC)OC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCC(CCCCC)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H30O4/c1-3-5-7-8-10-12-15(11-9-6-4-2)21-17(20)14-13-16(18)19/h13-15H,3-12H2,1-2H3,(H,18,19)/b14-13+