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

Systemtic Name: 3-[2-(2-chloranylpyridin-3-yl)carbonyloxybutanoylamino]benzoic acid Openeye Name: 3-[2-(2-chloropyridine-3-carbonyl)oxybutanoylamino]benzoic acid CAS Name: 3-[[2-[(2-chloro-3-pyridinyl)-oxomethoxy]-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[2-(2-chloropyridine-3-carbonyl)oxybutanoylamino]benzoic acid Traditional Name: 3-[2-(2-chloronicotinoyl)oxybutanoylamino]benzoic acid Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O5/c1-2-13(25-17(24)12-7-4-8-19-14(12)18)15(21)20-11-6-3-5-10(9-11)16(22)23/h3-9,13H,2H2,1H3,(H,20,21)(H,22,23)