5-bromanyl-2-[2-(3-methylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(3-methylphenoxy)ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-(3-methylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid Formula: C16H14BrNO4 MolecularWeight: 364.19066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO4/c1-10-3-2-4-12(7-10)22-9-15(19)18-14-6-5-11(17)8-13(14)16(20)21/h2-8H,9H2,1H3,(H,18,19)(H,20,21)