(2E)-7-pyridin-3-yl-2-[(2,3,6-trimethoxy-4,5-dimethyl-phenyl)methylidene]heptanoic acid

Systemtic Name: (2E)-7-pyridin-3-yl-2-[(2,3,6-trimethoxy-4,5-dimethyl-phenyl)methylidene]heptanoic acid Openeye Name: (2E)-7-(3-pyridyl)-2-[(2,3,6-trimethoxy-4,5-dimethyl-phenyl)methylene]heptanoic acid CAS Name: (2E)-7-(3-pyridinyl)-2-[(2,3,6-trimethoxy-4,5-dimethylphenyl)methylidene]heptanoic acid IUPAC Name: (2E)-7-pyridin-3-yl-2-[(2,3,6-trimethoxy-4,5-dimethylphenyl)methylidene]heptanoic acid Traditional Name: (E)-2-[5-(3-pyridyl)pentyl]-3-(2,3,6-trimethoxy-4,5-dimethyl-phenyl)acrylic acid Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1OC)C=C(CCCCCC2=CN=CC=C2)C(=O)O)OC)OC)C

Isomeric SMILES

CC1=C(C(=C(C(=C1OC)/C=C(\CCCCCC2=CN=CC=C2)/C(=O)O)OC)OC)C

InChI

InChI=1S/C24H31NO5/c1-16-17(2)22(29-4)23(30-5)20(21(16)28-3)14-19(24(26)27)12-8-6-7-10-18-11-9-13-25-15-18/h9,11,13-15H,6-8,10,12H2,1-5H3,(H,26,27)/b19-14+