5-bromanyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 5-bromanyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 5-bromo-1-methyl-pyrrole-2-carboxylic acid CAS Name: 5-bromo-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 5-bromo-1-methylpyrrole-2-carboxylic acid Traditional Name: 5-bromo-1-methyl-pyrrole-2-carboxylic acid Formula: C6H6BrNO2 MolecularWeight: 204.02134

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1Br)C(=O)O

Isomeric SMILES

CN1C(=CC=C1Br)C(=O)O

InChI

InChI=1S/C6H6BrNO2/c1-8-4(6(9)10)2-3-5(8)7/h2-3H,1H3,(H,9,10)