methyl 2-(2-bromanylbutanoylamino)benzoate

Systemtic Name: methyl 2-(2-bromanylbutanoylamino)benzoate Openeye Name: methyl 2-(2-bromobutanoylamino)benzoate CAS Name: 2-[(2-bromo-1-oxobutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-(2-bromobutanoylamino)benzoate Traditional Name: 2-(2-bromobutanoylamino)benzoic acid methyl ester Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)Br

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)Br

InChI

InChI=1S/C12H14BrNO3/c1-3-9(13)11(15)14-10-7-5-4-6-8(10)12(16)17-2/h4-7,9H,3H2,1-2H3,(H,14,15)