4-tert-butyl-3-[3-(4-ethanoyl-2-methoxy-phenyl)octanoylamino]benzoic acid

Systemtic Name: 4-tert-butyl-3-[3-(4-ethanoyl-2-methoxy-phenyl)octanoylamino]benzoic acid Openeye Name: 3-[3-(4-acetyl-2-methoxy-phenyl)octanoylamino]-4-tert-butyl-benzoic acid CAS Name: 3-[[3-(4-acetyl-2-methoxyphenyl)-1-oxooctyl]amino]-4-tert-butylbenzoic acid IUPAC Name: 3-[3-(4-acetyl-2-methoxyphenyl)octanoylamino]-4-tert-butylbenzoic acid Traditional Name: 3-[3-(4-acetyl-2-methoxy-phenyl)octanoylamino]-4-tert-butyl-benzoic acid Formula: C28H37NO5 MolecularWeight: 467.59708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37NO5/c1-7-8-9-10-20(22-13-11-19(18(2)30)16-25(22)34-6)17-26(31)29-24-15-21(27(32)33)12-14-23(24)28(3,4)5/h11-16,20H,7-10,17H2,1-6H3,(H,29,31)(H,32,33)