3-[2-(4-butan-2-ylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 3-[2-(4-butan-2-ylphenoxy)ethanoylamino]benzoic acid Openeye Name: 3-[[2-(4-sec-butylphenoxy)acetyl]amino]benzoic acid CAS Name: 3-[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(4-butan-2-ylphenoxy)acetyl]amino]benzoic acid Traditional Name: 3-[[2-(4-sec-butylphenoxy)acetyl]amino]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-3-13(2)14-7-9-17(10-8-14)24-12-18(21)20-16-6-4-5-15(11-16)19(22)23/h4-11,13H,3,12H2,1-2H3,(H,20,21)(H,22,23)