(E)-3-(3-ethoxy-4-octanoyloxy-phenyl)hept-2-enoic acid

Systemtic Name: (E)-3-(3-ethoxy-4-octanoyloxy-phenyl)hept-2-enoic acid Openeye Name: (E)-3-(3-ethoxy-4-octanoyloxy-phenyl)hept-2-enoic acid CAS Name: (E)-3-[3-ethoxy-4-(1-oxooctoxy)phenyl]-2-heptenoic acid IUPAC Name: (E)-3-(3-ethoxy-4-octanoyloxyphenyl)hept-2-enoic acid Traditional Name: (E)-3-(4-caprylyloxy-3-ethoxy-phenyl)hept-2-enoic acid Formula: C23H34O5 MolecularWeight: 390.51306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C(C=C(C=C1)C(=CC(=O)O)CCCC)OCC

Isomeric SMILES

CCCCCCCC(=O)OC1=C(C=C(C=C1)/C(=C/C(=O)O)/CCCC)OCC

InChI

InChI=1S/C23H34O5/c1-4-7-9-10-11-13-23(26)28-20-15-14-19(16-21(20)27-6-3)18(12-8-5-2)17-22(24)25/h14-17H,4-13H2,1-3H3,(H,24,25)/b18-17+