7-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-7-pyridin-3-yl-heptanoic acid

Systemtic Name: 7-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-7-pyridin-3-yl-heptanoic acid Openeye Name: 7-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-7-(3-pyridyl)heptanoic acid CAS Name: 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-7-(3-pyridinyl)heptanoic acid IUPAC Name: 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-7-pyridin-3-ylheptanoic acid Traditional Name: 7-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-7-(3-pyridyl)enanthic acid Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4/c1-15-16(2)23(28-5)21(17(3)22(15)27-4)19(18-10-9-13-24-14-18)11-7-6-8-12-20(25)26/h9-10,13-14,19H,6-8,11-12H2,1-5H3,(H,25,26)