2-chloranyl-5-[2-(2-ethyl-3-methyl-quinolin-4-yl)carbonyloxyethanoylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[2-(2-ethyl-3-methyl-quinolin-4-yl)carbonyloxyethanoylamino]benzoic acid Openeye Name: 2-chloro-5-[[2-(2-ethyl-3-methyl-quinoline-4-carbonyl)oxyacetyl]amino]benzoic acid CAS Name: 2-chloro-5-[[2-[(2-ethyl-3-methyl-4-quinolinyl)-oxomethoxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[[2-(2-ethyl-3-methylquinoline-4-carbonyl)oxyacetyl]amino]benzoic acid Traditional Name: 2-chloro-5-[[2-(2-ethyl-3-methyl-quinoline-4-carbonyl)oxyacetyl]amino]benzoic acid Formula: C22H19ClN2O5 MolecularWeight: 426.84966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C22H19ClN2O5/c1-3-17-12(2)20(14-6-4-5-7-18(14)25-17)22(29)30-11-19(26)24-13-8-9-16(23)15(10-13)21(27)28/h4-10H,3,11H2,1-2H3,(H,24,26)(H,27,28)