2-(4-fluoranylphenoxy)ethyl (E)-3-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]prop-2-enoate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl (E)-3-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]prop-2-enoate Openeye Name: 2-(4-fluorophenoxy)ethyl (E)-3-[3-ethoxy-4-(3-pyridylmethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-2-propenoic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl (E)-3-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-ethoxy-4-(3-pyridylmethoxy)phenyl]acrylic acid 2-(4-fluorophenoxy)ethyl ester Formula: C25H24FNO5 MolecularWeight: 437.460163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)OCCOC2=CC=C(C=C2)F)OCC3=CN=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)OCCOC2=CC=C(C=C2)F)OCC3=CN=CC=C3

InChI

InChI=1S/C25H24FNO5/c1-2-29-24-16-19(5-11-23(24)32-18-20-4-3-13-27-17-20)6-12-25(28)31-15-14-30-22-9-7-21(26)8-10-22/h3-13,16-17H,2,14-15,18H2,1H3/b12-6+