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

Systemtic Name: 4-[(4-bromanyl-1-propan-2-yl-pyrrol-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]benzoic acid CAS Name: 4-[[(4-bromo-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(4-bromo-1-propan-2-ylpyrrole-2-carbonyl)amino]benzoic acid Traditional Name: 4-[(4-bromo-1-isopropyl-pyrrole-2-carbonyl)amino]benzoic acid Formula: C15H15BrN2O3 MolecularWeight: 351.1952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C15H15BrN2O3/c1-9(2)18-8-11(16)7-13(18)14(19)17-12-5-3-10(4-6-12)15(20)21/h3-9H,1-2H3,(H,17,19)(H,20,21)