[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-1,2-oxazole-5-carboxylate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-1,2-oxazole-5-carboxylate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 3-methylisoxazole-5-carboxylate CAS Name: 3-methyl-5-isoxazolecarboxylic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 3-methyl-1,2-oxazole-5-carboxylate Traditional Name: 3-methylisoxazole-5-carboxylic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C13H11IN2O4 MolecularWeight: 386.14191

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=NOC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C13H11IN2O4/c1-8-5-11(20-16-8)13(18)19-7-12(17)15-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3,(H,15,17)