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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)N(C)C2=CC=CC=C2C(=O)O)Br

Isomeric SMILES

CCN1C=C(C=C1C(=O)N(C)C2=CC=CC=C2C(=O)O)Br

InChI

InChI=1S/C15H15BrN2O3/c1-3-18-9-10(16)8-13(18)14(19)17(2)12-7-5-4-6-11(12)15(20)21/h4-9H,3H2,1-2H3,(H,20,21)