methyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)COC1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)COC1=CC(=CC=C1)Br

InChI

InChI=1S/C14H18BrNO4/c1-9(2)13(14(18)19-3)16-12(17)8-20-11-6-4-5-10(15)7-11/h4-7,9,13H,8H2,1-3H3,(H,16,17)