2-[[3-[2-(2,6-dimethylphenoxy)ethanoylamino]-4-methyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[3-[2-(2,6-dimethylphenoxy)ethanoylamino]-4-methyl-phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-methyl-benzoyl]amino]benzoic acid CAS Name: 2-[[[3-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]-4-methylphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-methylbenzoyl]amino]benzoic acid Traditional Name: 2-[[3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-methyl-benzoyl]amino]benzoic acid Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)C

InChI

InChI=1S/C25H24N2O5/c1-15-11-12-18(24(29)27-20-10-5-4-9-19(20)25(30)31)13-21(15)26-22(28)14-32-23-16(2)7-6-8-17(23)3/h4-13H,14H2,1-3H3,(H,26,28)(H,27,29)(H,30,31)