ethyl (E)-3-pyridin-2-yl-3-(2,3,5-trimethyl-3H-1-benzofuran-2-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-pyridin-2-yl-3-(2,3,5-trimethyl-3H-1-benzofuran-2-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(2-pyridyl)-3-(2,3,5-trimethyl-3H-benzofuran-2-yl)prop-2-enoate CAS Name: (E)-3-(2-pyridinyl)-3-(2,3,5-trimethyl-3H-benzofuran-2-yl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-pyridin-2-yl-3-(2,3,5-trimethyl-3H-1-benzofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(2-pyridyl)-3-(2,3,5-trimethylcoumaran-2-yl)acrylic acid ethyl ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C1=CC=CC=N1)C2(C(C3=C(O2)C=CC(=C3)C)C)C

Isomeric SMILES

CCOC(=O)/C=C(\C1=CC=CC=N1)/C2(C(C3=C(O2)C=CC(=C3)C)C)C

InChI

InChI=1S/C21H23NO3/c1-5-24-20(23)13-17(18-8-6-7-11-22-18)21(4)15(3)16-12-14(2)9-10-19(16)25-21/h6-13,15H,5H2,1-4H3/b17-13+