3-[[2-(4-bromanylphenoxy)-2-methyl-propanoyl]amino]benzoic acid

Systemtic Name: 3-[[2-(4-bromanylphenoxy)-2-methyl-propanoyl]amino]benzoic acid Openeye Name: 3-[[2-(4-bromophenoxy)-2-methyl-propanoyl]amino]benzoic acid CAS Name: 3-[[2-(4-bromophenoxy)-2-methyl-1-oxopropyl]amino]benzoic acid IUPAC Name: 3-[[2-(4-bromophenoxy)-2-methylpropanoyl]amino]benzoic acid Traditional Name: 3-[[2-(4-bromophenoxy)-2-methyl-propanoyl]amino]benzoic acid Formula: C17H16BrNO4 MolecularWeight: 378.21724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=CC(=C1)C(=O)O)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CC=CC(=C1)C(=O)O)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO4/c1-17(2,23-14-8-6-12(18)7-9-14)16(22)19-13-5-3-4-11(10-13)15(20)21/h3-10H,1-2H3,(H,19,22)(H,20,21)