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

Systemtic Name: (2E)-5-pyridin-3-yl-2-[(2,4,5-trimethoxy-3,6-dimethyl-phenyl)methylidene]pentanoic acid Openeye Name: (2E)-5-(3-pyridyl)-2-[(2,4,5-trimethoxy-3,6-dimethyl-phenyl)methylene]pentanoic acid CAS Name: (2E)-5-(3-pyridinyl)-2-[(2,4,5-trimethoxy-3,6-dimethylphenyl)methylidene]pentanoic acid IUPAC Name: (2E)-5-pyridin-3-yl-2-[(2,4,5-trimethoxy-3,6-dimethylphenyl)methylidene]pentanoic acid Traditional Name: (E)-2-[3-(3-pyridyl)propyl]-3-(2,4,5-trimethoxy-3,6-dimethyl-phenyl)acrylic acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1OC)OC)C)OC)C=C(CCCC2=CN=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=C1OC)OC)C)OC)/C=C(\CCCC2=CN=CC=C2)/C(=O)O

InChI

InChI=1S/C22H27NO5/c1-14-18(19(26-3)15(2)21(28-5)20(14)27-4)12-17(22(24)25)10-6-8-16-9-7-11-23-13-16/h7,9,11-13H,6,8,10H2,1-5H3,(H,24,25)/b17-12+