2-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl-methyl-amino]benzoic acid

Systemtic Name: 2-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl-methyl-amino]benzoic acid Openeye Name: 2-[(4-bromo-1H-pyrrole-2-carbonyl)-methyl-amino]benzoic acid CAS Name: 2-[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]-methylamino]benzoic acid IUPAC Name: 2-[(4-bromo-1H-pyrrole-2-carbonyl)-methylamino]benzoic acid Traditional Name: 2-[(4-bromo-1H-pyrrole-2-carbonyl)-methyl-amino]benzoic acid Formula: C13H11BrN2O3 MolecularWeight: 323.14204

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC(=CN2)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H11BrN2O3/c1-16(12(17)10-6-8(14)7-15-10)11-5-3-2-4-9(11)13(18)19/h2-7,15H,1H3,(H,18,19)