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

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethanoylamino]-2-methyl-benzoic acid Openeye Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-2-methyl-benzoic acid CAS Name: 3-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-2-methylbenzoic acid IUPAC Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-2-methylbenzoic acid Traditional Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-2-methyl-benzoic acid Formula: C16H14BrNO4 MolecularWeight: 364.19066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)COC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)COC2=CC=C(C=C2)Br)C(=O)O

InChI

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