ethyl (E)-7-[(1R,2S)-2-dodecyl-5-oxidanylidene-cyclopentyl]hept-2-enoate

Systemtic Name: ethyl (E)-7-[(1R,2S)-2-dodecyl-5-oxidanylidene-cyclopentyl]hept-2-enoate Openeye Name: ethyl (E)-7-[(1R,2S)-2-dodecyl-5-oxo-cyclopentyl]hept-2-enoate CAS Name: (E)-7-[(1R,2S)-2-dodecyl-5-oxocyclopentyl]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[(1R,2S)-2-dodecyl-5-oxocyclopentyl]hept-2-enoate Traditional Name: (E)-7-[(1R,5S)-2-keto-5-lauryl-cyclopentyl]hept-2-enoic acid ethyl ester Formula: C26H46O3 MolecularWeight: 406.64164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(=O)C1CCCCC=CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC[C@H]1CCC(=O)[C@@H]1CCCC/C=C/C(=O)OCC

InChI

InChI=1S/C26H46O3/c1-3-5-6-7-8-9-10-11-12-15-18-23-21-22-25(27)24(23)19-16-13-14-17-20-26(28)29-4-2/h17,20,23-24H,3-16,18-19,21-22H2,1-2H3/b20-17+/t23-,24+/m0/s1