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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

CCCN1C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C15H15BrN2O3/c1-2-7-18-9-11(16)8-13(18)14(19)17-12-5-3-10(4-6-12)15(20)21/h3-6,8-9H,2,7H2,1H3,(H,17,19)(H,20,21)