4-[2-[(5-bromanylpyridin-3-yl)carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(5-bromanylpyridin-3-yl)carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(5-bromopyridine-3-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(5-bromopyridine-3-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(5-bromonicotinoyl)amino]ethyl]benzoic acid Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC(=CN=C2)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC(=CN=C2)Br)C(=O)O

InChI

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