4-chloranyl-3-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]benzoic acid Openeye Name: 4-chloro-3-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(3-ethyl-5-methyl-4-isoxazolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]benzoic acid Formula: C14H13ClN2O4 MolecularWeight: 308.71702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl)C

InChI

InChI=1S/C14H13ClN2O4/c1-3-10-12(7(2)21-17-10)13(18)16-11-6-8(14(19)20)4-5-9(11)15/h4-6H,3H2,1-2H3,(H,16,18)(H,19,20)