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icosyl (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate

icosyl (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate

Systemtic Name:icosyl (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate
Openeye Name:icosyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
CAS Name:(E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid eicosyl ester
IUPAC Name:icosyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Traditional Name:(E)-3-(3,4-dihydroxyphenyl)acrylic acid arachyl ester
Formula: C29H48O4
MolecularWeight: 460.68902
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/C1=CC(=C(C=C1)O)O


InChI

InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33-29(32)23-21-26-20-22-27(30)28(31)25-26/h20-23,25,30-31H,2-19,24H2,1H3/b23-21+


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