(E)-3-(4-hexadecoxy-3-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-hexadecoxy-3-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-hexadecoxy-3-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(4-hexadecoxy-3-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-hexadecoxy-3-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-cetyloxy-3-methoxy-phenyl)acrylic acid Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-30-24-19-17-23(18-20-26(27)28)22-25(24)29-2/h17-20,22H,3-16,21H2,1-2H3,(H,27,28)/b20-18+