(phenylmethyl) (E)-6-(8-oxidanyl-1,4-dioxaspiro[4.5]decan-9-yl)hex-4-enoate

Systemtic Name: (phenylmethyl) (E)-6-(8-oxidanyl-1,4-dioxaspiro[4.5]decan-9-yl)hex-4-enoate Openeye Name: benzyl (E)-6-(8-hydroxy-1,4-dioxaspiro[4.5]decan-9-yl)hex-4-enoate CAS Name: (E)-6-(8-hydroxy-1,4-dioxaspiro[4.5]decan-9-yl)-4-hexenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E)-6-(8-hydroxy-1,4-dioxaspiro[4.5]decan-9-yl)hex-4-enoate Traditional Name: (E)-6-(8-hydroxy-1,4-dioxaspiro[4.5]decan-9-yl)hex-4-enoic acid benzyl ester Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC(C1O)CC=CCCC(=O)OCC3=CC=CC=C3)OCCO2

Isomeric SMILES

C1CC2(CC(C1O)C/C=C/CCC(=O)OCC3=CC=CC=C3)OCCO2

InChI

InChI=1S/C21H28O5/c22-19-11-12-21(25-13-14-26-21)15-18(19)9-5-2-6-10-20(23)24-16-17-7-3-1-4-8-17/h1-5,7-8,18-19,22H,6,9-16H2/b5-2+