ethyl (2E)-2-[(4-ethoxy-2,5-dimethoxy-3,6-dimethyl-phenyl)methylidene]-7-pyridin-3-yl-heptanoate

Systemtic Name: ethyl (2E)-2-[(4-ethoxy-2,5-dimethoxy-3,6-dimethyl-phenyl)methylidene]-7-pyridin-3-yl-heptanoate Openeye Name: ethyl (2E)-2-[(4-ethoxy-2,5-dimethoxy-3,6-dimethyl-phenyl)methylene]-7-(3-pyridyl)heptanoate CAS Name: (2E)-2-[(4-ethoxy-2,5-dimethoxy-3,6-dimethylphenyl)methylidene]-7-(3-pyridinyl)heptanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(4-ethoxy-2,5-dimethoxy-3,6-dimethylphenyl)methylidene]-7-pyridin-3-ylheptanoate Traditional Name: (E)-3-(4-ethoxy-2,5-dimethoxy-3,6-dimethyl-phenyl)-2-[5-(3-pyridyl)pentyl]acrylic acid ethyl ester Formula: C27H37NO5 MolecularWeight: 455.58638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1C)OC)C=C(CCCCCC2=CN=CC=C2)C(=O)OCC)C)OC

Isomeric SMILES

CCOC1=C(C(=C(C(=C1C)OC)/C=C(\CCCCCC2=CN=CC=C2)/C(=O)OCC)C)OC

InChI

InChI=1S/C27H37NO5/c1-7-32-26-20(4)24(30-5)23(19(3)25(26)31-6)17-22(27(29)33-8-2)15-11-9-10-13-21-14-12-16-28-18-21/h12,14,16-18H,7-11,13,15H2,1-6H3/b22-17+