(E)-3-(4-hexadecoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-hexadecoxyphenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-hexadecoxyphenyl)prop-2-enoic acid CAS Name: (E)-3-(4-hexadecoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-hexadecoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-cetyloxyphenyl)acrylic acid Formula: C25H40O3 MolecularWeight: 388.5833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C25H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-28-24-19-16-23(17-20-24)18-21-25(26)27/h16-21H,2-15,22H2,1H3,(H,26,27)/b21-18+