hexadecyl (E)-3-(2-ethyl-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: hexadecyl (E)-3-(2-ethyl-4-methoxy-phenyl)prop-2-enoate Openeye Name: hexadecyl (E)-3-(2-ethyl-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(2-ethyl-4-methoxyphenyl)-2-propenoic acid hexadecyl ester IUPAC Name: hexadecyl (E)-3-(2-ethyl-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2-ethyl-4-methoxy-phenyl)acrylic acid cetyl ester Formula: C28H46O3 MolecularWeight: 430.66304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C=CC1=C(C=C(C=C1)OC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)/C=C/C1=C(C=C(C=C1)OC)CC

InChI

InChI=1S/C28H46O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-31-28(29)22-20-26-19-21-27(30-3)24-25(26)5-2/h19-22,24H,4-18,23H2,1-3H3/b22-20+