2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid

Systemtic Name: 2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]butyric acid Formula: C10H13BrN2O3 MolecularWeight: 289.12582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)Br

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)Br

InChI

InChI=1S/C10H13BrN2O3/c1-3-7(10(15)16)12-9(14)8-4-6(11)5-13(8)2/h4-5,7H,3H2,1-2H3,(H,12,14)(H,15,16)