3-[(4-bromanyl-1-cyclopropyl-pyrrol-2-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(4-bromanyl-1-cyclopropyl-pyrrol-2-yl)carbonylamino]benzoic acid Openeye Name: 3-[(4-bromo-1-cyclopropyl-pyrrole-2-carbonyl)amino]benzoic acid CAS Name: 3-[[(4-bromo-1-cyclopropyl-2-pyrrolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(4-bromo-1-cyclopropylpyrrole-2-carbonyl)amino]benzoic acid Traditional Name: 3-[(4-bromo-1-cyclopropyl-pyrrole-2-carbonyl)amino]benzoic acid Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C=C2C(=O)NC3=CC=CC(=C3)C(=O)O)Br

Isomeric SMILES

C1CC1N2C=C(C=C2C(=O)NC3=CC=CC(=C3)C(=O)O)Br

InChI

InChI=1S/C15H13BrN2O3/c16-10-7-13(18(8-10)12-4-5-12)14(19)17-11-3-1-2-9(6-11)15(20)21/h1-3,6-8,12H,4-5H2,(H,17,19)(H,20,21)