3-[2-(2,6-dimethylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 3-[2-(2,6-dimethylphenoxy)ethanoylamino]benzoic acid Openeye Name: 3-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid CAS Name: 3-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid Traditional Name: 3-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-11-5-3-6-12(2)16(11)22-10-15(19)18-14-8-4-7-13(9-14)17(20)21/h3-9H,10H2,1-2H3,(H,18,19)(H,20,21)