2,3-dimethoxy-5-pyridin-3-yl-2-(2,4,5-trimethylphenyl)pentanoic acid

Systemtic Name: 2,3-dimethoxy-5-pyridin-3-yl-2-(2,4,5-trimethylphenyl)pentanoic acid Openeye Name: 2,3-dimethoxy-5-(3-pyridyl)-2-(2,4,5-trimethylphenyl)pentanoic acid CAS Name: 2,3-dimethoxy-5-(3-pyridinyl)-2-(2,4,5-trimethylphenyl)pentanoic acid IUPAC Name: 2,3-dimethoxy-5-pyridin-3-yl-2-(2,4,5-trimethylphenyl)pentanoic acid Traditional Name: 2,3-dimethoxy-5-(3-pyridyl)-2-(2,4,5-trimethylphenyl)valeric acid Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(C(CCC2=CN=CC=C2)OC)(C(=O)O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1C)C(C(CCC2=CN=CC=C2)OC)(C(=O)O)OC)C

InChI

InChI=1S/C21H27NO4/c1-14-11-16(3)18(12-15(14)2)21(26-5,20(23)24)19(25-4)9-8-17-7-6-10-22-13-17/h6-7,10-13,19H,8-9H2,1-5H3,(H,23,24)