4-chloranyl-3-[2-(2-chloranylpyridin-3-yl)carbonyloxybutanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-(2-chloranylpyridin-3-yl)carbonyloxybutanoylamino]benzoic acid Openeye Name: 4-chloro-3-[2-(2-chloropyridine-3-carbonyl)oxybutanoylamino]benzoic acid CAS Name: 4-chloro-3-[[2-[(2-chloro-3-pyridinyl)-oxomethoxy]-1-oxobutyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[2-(2-chloropyridine-3-carbonyl)oxybutanoylamino]benzoic acid Traditional Name: 4-chloro-3-[2-(2-chloronicotinoyl)oxybutanoylamino]benzoic acid Formula: C17H14Cl2N2O5 MolecularWeight: 397.20946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C17H14Cl2N2O5/c1-2-13(26-17(25)10-4-3-7-20-14(10)19)15(22)21-12-8-9(16(23)24)5-6-11(12)18/h3-8,13H,2H2,1H3,(H,21,22)(H,23,24)