ethyl 4-(2-bromanylbutanoylamino)benzoate

Systemtic Name: ethyl 4-(2-bromanylbutanoylamino)benzoate Openeye Name: ethyl 4-(2-bromobutanoylamino)benzoate CAS Name: 4-[(2-bromo-1-oxobutyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-bromobutanoylamino)benzoate Traditional Name: 4-(2-bromobutanoylamino)benzoic acid ethyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)Br

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)Br

InChI

InChI=1S/C13H16BrNO3/c1-3-11(14)12(16)15-10-7-5-9(6-8-10)13(17)18-4-2/h5-8,11H,3-4H2,1-2H3,(H,15,16)