1,3-benzodioxol-5-yl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: 1,3-benzodioxol-5-yl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate Openeye Name: 1,3-benzodioxol-5-yl (E)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-2-propenoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (E)-3-(3-fluoro-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)acrylic acid 1,3-benzodioxol-5-yl ester Formula: C17H13FO5 MolecularWeight: 316.280523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C17H13FO5/c1-20-14-5-2-11(8-13(14)18)3-7-17(19)23-12-4-6-15-16(9-12)22-10-21-15/h2-9H,10H2,1H3/b7-3+