3-methyl-4-[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]benzoic acid

Systemtic Name: 3-methyl-4-[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetyl]amino]-3-methyl-benzoic acid CAS Name: 3-methyl-4-[[2-(6-methyl-5-propan-2-yl-3-benzofuranyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetyl]amino]-3-methyl-benzoic acid Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CC2=COC3=CC(=C(C=C32)C(C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CC2=COC3=CC(=C(C=C32)C(C)C)C

InChI

InChI=1S/C22H23NO4/c1-12(2)17-10-18-16(11-27-20(18)8-13(17)3)9-21(24)23-19-6-5-15(22(25)26)7-14(19)4/h5-8,10-12H,9H2,1-4H3,(H,23,24)(H,25,26)