4-bromanyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-bromanyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C7H8BrNO2 MolecularWeight: 218.04792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1Br)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1Br)C)C(=O)O

InChI

InChI=1S/C7H8BrNO2/c1-3-5(8)4(2)9-6(3)7(10)11/h9H,1-2H3,(H,10,11)