6-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]hexanoic acid

Systemtic Name: 6-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]hexanoic acid Openeye Name: 6-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]hexanoic acid CAS Name: 6-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]hexanoic acid Traditional Name: 6-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]hexanoic acid Formula: C12H17BrN2O3 MolecularWeight: 317.17898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCCCC(=O)O)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCCCC(=O)O)Br

InChI

InChI=1S/C12H17BrN2O3/c1-15-8-9(13)7-10(15)12(18)14-6-4-2-3-5-11(16)17/h7-8H,2-6H2,1H3,(H,14,18)(H,16,17)