7-(7-oxidanylheptylamino)heptyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: 7-(7-oxidanylheptylamino)heptyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: 7-(7-hydroxyheptylamino)heptyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4,5-trimethoxyphenyl)-2-propenoic acid 7-(7-hydroxyheptylamino)heptyl ester IUPAC Name: 7-(7-hydroxyheptylamino)heptyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid 7-(7-hydroxyheptylamino)heptyl ester Formula: C26H43NO6 MolecularWeight: 465.62272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCCCCCCCNCCCCCCCO

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)OCCCCCCCNCCCCCCCO

InChI

InChI=1S/C26H43NO6/c1-30-23-20-22(21-24(31-2)26(23)32-3)14-15-25(29)33-19-13-9-5-7-11-17-27-16-10-6-4-8-12-18-28/h14-15,20-21,27-28H,4-13,16-19H2,1-3H3/b15-14+