2-[(3-bromanyl-2,5-dimethoxy-phenyl)carbonylamino]butanoic acid

Systemtic Name: 2-[(3-bromanyl-2,5-dimethoxy-phenyl)carbonylamino]butanoic acid Openeye Name: 2-[(3-bromo-2,5-dimethoxy-benzoyl)amino]butanoic acid CAS Name: 2-[[(3-bromo-2,5-dimethoxyphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(3-bromo-2,5-dimethoxybenzoyl)amino]butanoic acid Traditional Name: 2-[(3-bromo-2,5-dimethoxy-benzoyl)amino]butyric acid Formula: C13H16BrNO5 MolecularWeight: 346.17384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CC(=C1OC)Br)OC

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CC(=C1OC)Br)OC

InChI

InChI=1S/C13H16BrNO5/c1-4-10(13(17)18)15-12(16)8-5-7(19-2)6-9(14)11(8)20-3/h5-6,10H,4H2,1-3H3,(H,15,16)(H,17,18)