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

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

Systemtic Name:hentriacontyl (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate
Openeye Name:hentriacontyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
CAS Name:(E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid hentriacontyl ester
IUPAC Name:hentriacontyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Traditional Name:(E)-3-(3,4-dihydroxyphenyl)acrylic acid hentriacontyl ester
Formula: C40H70O4
MolecularWeight: 614.9814
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C40H70O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-35-44-40(43)34-32-37-31-33-38(41)39(42)36-37/h31-34,36,41-42H,2-30,35H2,1H3/b34-32+


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