5-bromanyl-2-(pyridin-4-ylcarbamoylamino)benzoic acid

Systemtic Name: 5-bromanyl-2-(pyridin-4-ylcarbamoylamino)benzoic acid Openeye Name: 5-bromo-2-(4-pyridylcarbamoylamino)benzoic acid CAS Name: 5-bromo-2-[[oxo-(pyridin-4-ylamino)methyl]amino]benzoic acid IUPAC Name: 5-bromo-2-(pyridin-4-ylcarbamoylamino)benzoic acid Traditional Name: 5-bromo-2-(4-pyridylcarbamoylamino)benzoic acid Formula: C13H10BrN3O3 MolecularWeight: 336.1408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)NC2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)NC2=CC=NC=C2

InChI

InChI=1S/C13H10BrN3O3/c14-8-1-2-11(10(7-8)12(18)19)17-13(20)16-9-3-5-15-6-4-9/h1-7H,(H,18,19)(H2,15,16,17,20)