4-[2-(2,3,6-trimethylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(2,3,6-trimethylphenoxy)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]benzoic acid CAS Name: 4-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]benzoic acid IUPAC Name: 4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]benzoic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO4/c1-11-4-5-12(2)17(13(11)3)23-10-16(20)19-15-8-6-14(7-9-15)18(21)22/h4-9H,10H2,1-3H3,(H,19,20)(H,21,22)