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

Systemtic Name: 4-[[2-[2-(2,6-dimethylphenoxy)ethanoylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid CAS Name: 4-[[[2-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid Traditional Name: 4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H22N2O5/c1-15-6-5-7-16(2)22(15)31-14-21(27)26-20-9-4-3-8-19(20)23(28)25-18-12-10-17(11-13-18)24(29)30/h3-13H,14H2,1-2H3,(H,25,28)(H,26,27)(H,29,30)