3-[2-(4-bromanylphenoxy)ethanoylamino]-4-methyl-benzoate

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethanoylamino]-4-methyl-benzoate Openeye Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-4-methylbenzoate IUPAC Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-4-methyl-benzoate Formula: C16H13BrNO4- MolecularWeight: 363.18272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)COC2=CC=C(C=C2)Br

InChI

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