(3S,4R)-3-[(E,2R,5S)-1,1-diethoxy-5-phenylmethoxy-dec-3-en-2-yl]-4-heptyl-oxolan-2-one

Systemtic Name: (3S,4R)-3-[(E,2R,5S)-1,1-diethoxy-5-phenylmethoxy-dec-3-en-2-yl]-4-heptyl-oxolan-2-one Openeye Name: (3S,4R)-3-[(E,1R,4S)-4-benzyloxy-1-(diethoxymethyl)non-2-enyl]-4-heptyl-tetrahydrofuran-2-one CAS Name: (3S,4R)-3-[(E,2R,5S)-1,1-diethoxy-5-phenylmethoxydec-3-en-2-yl]-4-heptyl-2-oxolanone IUPAC Name: (3S,4R)-3-[(E,2R,5S)-1,1-diethoxy-5-phenylmethoxydec-3-en-2-yl]-4-heptyloxolan-2-one Traditional Name: (3S,4R)-3-[(E,1R,4S)-4-benzoxy-1-(diethoxymethyl)non-2-enyl]-4-heptyl-tetrahydrofuran-2-one Formula: C32H52O5 MolecularWeight: 516.75228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(=O)C1C(C=CC(CCCCC)OCC2=CC=CC=C2)C(OCC)OCC

Isomeric SMILES

CCCCCCC[C@H]1COC(=O)[C@@H]1[C@@H](/C=C/[C@H](CCCCC)OCC2=CC=CC=C2)C(OCC)OCC

InChI

InChI=1S/C32H52O5/c1-5-9-11-12-17-20-27-25-37-31(33)30(27)29(32(34-7-3)35-8-4)23-22-28(21-14-10-6-2)36-24-26-18-15-13-16-19-26/h13,15-16,18-19,22-23,27-30,32H,5-12,14,17,20-21,24-25H2,1-4H3/b23-22+/t27-,28-,29+,30-/m0/s1