octadecyl (2E)-2-[5-(hydroxymethyl)-5-(phenylmethoxymethyl)oxolan-3-ylidene]ethanoate

Systemtic Name: octadecyl (2E)-2-[5-(hydroxymethyl)-5-(phenylmethoxymethyl)oxolan-3-ylidene]ethanoate Openeye Name: octadecyl (2E)-2-[5-(benzyloxymethyl)-5-(hydroxymethyl)tetrahydrofuran-3-ylidene]acetate CAS Name: (2E)-2-[5-(hydroxymethyl)-5-(phenylmethoxymethyl)-3-oxolanylidene]acetic acid octadecyl ester IUPAC Name: octadecyl (2E)-2-[5-(hydroxymethyl)-5-(phenylmethoxymethyl)oxolan-3-ylidene]acetate Traditional Name: (2E)-2-[5-(benzoxymethyl)-5-methylol-tetrahydrofuran-3-ylidene]acetic acid stearyl ester Formula: C33H54O5 MolecularWeight: 530.77886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C=C1CC(OC1)(CO)COCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)/C=C/1\CC(OC1)(CO)COCC2=CC=CC=C2

InChI

InChI=1S/C33H54O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-37-32(35)24-31-25-33(28-34,38-27-31)29-36-26-30-21-18-17-19-22-30/h17-19,21-22,24,34H,2-16,20,23,25-29H2,1H3/b31-24+