(E)-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)icos-4-enoic acid

Systemtic Name: (E)-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)icos-4-enoic acid Openeye Name: (E)-2-(2-benzyloxy-2-oxo-ethyl)icos-4-enoic acid CAS Name: (E)-2-(2-oxo-2-phenylmethoxyethyl)-4-eicosenoic acid IUPAC Name: (E)-2-(2-oxo-2-phenylmethoxyethyl)icos-4-enoic acid Traditional Name: (E)-2-(2-benzoxy-2-keto-ethyl)eicos-4-enoic acid Formula: C29H46O4 MolecularWeight: 458.67314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=CCC(CC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/CC(CC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C29H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27(29(31)32)24-28(30)33-25-26-21-18-17-19-22-26/h16-22,27H,2-15,23-25H2,1H3,(H,31,32)/b20-16+