[(E)-6-[3-(iodanylmethyl)-5-oxidanylidene-2-(3-oxidanylidenedecyl)cyclopentyl]hex-4-enyl] 2-methylpropanoate

Systemtic Name: [(E)-6-[3-(iodanylmethyl)-5-oxidanylidene-2-(3-oxidanylidenedecyl)cyclopentyl]hex-4-enyl] 2-methylpropanoate Openeye Name: [(E)-6-[3-(iodomethyl)-5-oxo-2-(3-oxodecyl)cyclopentyl]hex-4-enyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(E)-6-[3-(iodomethyl)-5-oxo-2-(3-oxodecyl)cyclopentyl]hex-4-enyl] ester IUPAC Name: [(E)-6-[3-(iodomethyl)-5-oxo-2-(3-oxodecyl)cyclopentyl]hex-4-enyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(E)-6-[3-(iodomethyl)-5-keto-2-(3-ketodecyl)cyclopentyl]hex-4-enyl] ester Formula: C26H43IO4 MolecularWeight: 546.52169

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CCC1C(CC(=O)C1CC=CCCCOC(=O)C(C)C)CI

Isomeric SMILES

CCCCCCCC(=O)CCC1C(CC(=O)C1C/C=C/CCCOC(=O)C(C)C)CI

InChI

InChI=1S/C26H43IO4/c1-4-5-6-7-10-13-22(28)15-16-23-21(19-27)18-25(29)24(23)14-11-8-9-12-17-31-26(30)20(2)3/h8,11,20-21,23-24H,4-7,9-10,12-19H2,1-3H3/b11-8+