2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3,3-dimethyl-butyric acid Formula: C12H17BrN2O3 MolecularWeight: 317.17898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrN2O3/c1-12(2,3)9(11(17)18)14-10(16)8-5-7(13)6-15(8)4/h5-6,9H,1-4H3,(H,14,16)(H,17,18)