3-[3-(2-methoxypyridin-3-yl)octanoylamino]-4-(4-methylphenyl)benzoic acid

Systemtic Name: 3-[3-(2-methoxypyridin-3-yl)octanoylamino]-4-(4-methylphenyl)benzoic acid Openeye Name: 3-[3-(2-methoxy-3-pyridyl)octanoylamino]-4-(p-tolyl)benzoic acid CAS Name: 3-[[3-(2-methoxy-3-pyridinyl)-1-oxooctyl]amino]-4-(4-methylphenyl)benzoic acid IUPAC Name: 3-[3-(2-methoxypyridin-3-yl)octanoylamino]-4-(4-methylphenyl)benzoic acid Traditional Name: 3-[3-(2-methoxy-3-pyridyl)octanoylamino]-4-(p-tolyl)benzoic acid Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)O)C2=CC=C(C=C2)C)C3=C(N=CC=C3)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)O)C2=CC=C(C=C2)C)C3=C(N=CC=C3)OC

InChI

InChI=1S/C28H32N2O4/c1-4-5-6-8-21(24-9-7-16-29-27(24)34-3)18-26(31)30-25-17-22(28(32)33)14-15-23(25)20-12-10-19(2)11-13-20/h7,9-17,21H,4-6,8,18H2,1-3H3,(H,30,31)(H,32,33)