(E)-2-(2-nonan-4-yloxy-2-oxidanylidene-ethyl)icos-4-enoic acid

Systemtic Name: (E)-2-(2-nonan-4-yloxy-2-oxidanylidene-ethyl)icos-4-enoic acid Openeye Name: (E)-2-[2-oxo-2-(1-propylhexoxy)ethyl]icos-4-enoic acid CAS Name: (E)-2-(2-nonan-4-yloxy-2-oxoethyl)-4-eicosenoic acid IUPAC Name: (E)-2-(2-nonan-4-yloxy-2-oxoethyl)icos-4-enoic acid Traditional Name: (E)-2-[2-keto-2-(1-propylhexoxy)ethyl]eicos-4-enoic acid Formula: C31H58O4 MolecularWeight: 494.78982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=CCC(CC(=O)OC(CCC)CCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/CC(CC(=O)OC(CCC)CCCCC)C(=O)O

InChI

InChI=1S/C31H58O4/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-28(31(33)34)27-30(32)35-29(24-6-3)26-22-8-5-2/h21,23,28-29H,4-20,22,24-27H2,1-3H3,(H,33,34)/b23-21+