2-[(2-bromanyl-5-methoxy-phenyl)carbonylamino]butanoic acid

Systemtic Name: 2-[(2-bromanyl-5-methoxy-phenyl)carbonylamino]butanoic acid Openeye Name: 2-[(2-bromo-5-methoxy-benzoyl)amino]butanoic acid CAS Name: 2-[[(2-bromo-5-methoxyphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(2-bromo-5-methoxybenzoyl)amino]butanoic acid Traditional Name: 2-[(2-bromo-5-methoxy-benzoyl)amino]butyric acid Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO4/c1-3-10(12(16)17)14-11(15)8-6-7(18-2)4-5-9(8)13/h4-6,10H,3H2,1-2H3,(H,14,15)(H,16,17)