[(4E)-2-(hydroxymethyl)-4-octylidene-5-oxidanylidene-oxolan-2-yl]methyl 3-phenylpropanoate

Systemtic Name: [(4E)-2-(hydroxymethyl)-4-octylidene-5-oxidanylidene-oxolan-2-yl]methyl 3-phenylpropanoate Openeye Name: [(4E)-2-(hydroxymethyl)-4-octylidene-5-oxo-tetrahydrofuran-2-yl]methyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [(4E)-2-(hydroxymethyl)-4-octylidene-5-oxo-2-oxolanyl]methyl ester IUPAC Name: [(4E)-2-(hydroxymethyl)-4-octylidene-5-oxooxolan-2-yl]methyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [(4E)-5-keto-2-methylol-4-octylidene-tetrahydrofuran-2-yl]methyl ester Formula: C23H32O5 MolecularWeight: 388.49718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=C1CC(OC1=O)(CO)COC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC/C=C/1\CC(OC1=O)(CO)COC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C23H32O5/c1-2-3-4-5-6-10-13-20-16-23(17-24,28-22(20)26)18-27-21(25)15-14-19-11-8-7-9-12-19/h7-9,11-13,24H,2-6,10,14-18H2,1H3/b20-13+