ethyl (2E)-2-[(3-butoxy-2,5-dimethoxy-4,6-dimethyl-phenyl)methylidene]-5-pyridin-3-yl-pentanoate

Systemtic Name: ethyl (2E)-2-[(3-butoxy-2,5-dimethoxy-4,6-dimethyl-phenyl)methylidene]-5-pyridin-3-yl-pentanoate Openeye Name: ethyl (2E)-2-[(3-butoxy-2,5-dimethoxy-4,6-dimethyl-phenyl)methylene]-5-(3-pyridyl)pentanoate CAS Name: (2E)-2-[(3-butoxy-2,5-dimethoxy-4,6-dimethylphenyl)methylidene]-5-(3-pyridinyl)pentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(3-butoxy-2,5-dimethoxy-4,6-dimethylphenyl)methylidene]-5-pyridin-3-ylpentanoate Traditional Name: (E)-3-(3-butoxy-2,5-dimethoxy-4,6-dimethyl-phenyl)-2-[3-(3-pyridyl)propyl]acrylic acid ethyl ester Formula: C27H37NO5 MolecularWeight: 455.58638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C(=C1C)OC)C)C=C(CCCC2=CN=CC=C2)C(=O)OCC)OC

Isomeric SMILES

CCCCOC1=C(C(=C(C(=C1C)OC)C)/C=C(\CCCC2=CN=CC=C2)/C(=O)OCC)OC

InChI

InChI=1S/C27H37NO5/c1-7-9-16-33-25-20(4)24(30-5)19(3)23(26(25)31-6)17-22(27(29)32-8-2)14-10-12-21-13-11-15-28-18-21/h11,13,15,17-18H,7-10,12,14,16H2,1-6H3/b22-17+