4-tert-butyl-5-[[3-(2,6-dimethoxypyridin-3-yl)-7-methyl-octanoyl]amino]-2-methyl-benzoic acid

Systemtic Name: 4-tert-butyl-5-[[3-(2,6-dimethoxypyridin-3-yl)-7-methyl-octanoyl]amino]-2-methyl-benzoic acid Openeye Name: 4-tert-butyl-5-[[3-(2,6-dimethoxy-3-pyridyl)-7-methyl-octanoyl]amino]-2-methyl-benzoic acid CAS Name: 4-tert-butyl-5-[[3-(2,6-dimethoxy-3-pyridinyl)-7-methyl-1-oxooctyl]amino]-2-methylbenzoic acid IUPAC Name: 4-tert-butyl-5-[[3-(2,6-dimethoxypyridin-3-yl)-7-methyloctanoyl]amino]-2-methylbenzoic acid Traditional Name: 4-tert-butyl-5-[[3-(2,6-dimethoxy-3-pyridyl)-7-methyl-octanoyl]amino]-2-methyl-benzoic acid Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)NC(=O)CC(CCCC(C)C)C2=C(N=C(C=C2)OC)OC)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)NC(=O)CC(CCCC(C)C)C2=C(N=C(C=C2)OC)OC)C(C)(C)C

InChI

InChI=1S/C28H40N2O5/c1-17(2)10-9-11-19(20-12-13-25(34-7)30-26(20)35-8)15-24(31)29-23-16-21(27(32)33)18(3)14-22(23)28(4,5)6/h12-14,16-17,19H,9-11,15H2,1-8H3,(H,29,31)(H,32,33)