[2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(2-iodoanilino)-2-oxo-ethyl] 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid [2-(2-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-iodoanilino)-2-oxoethyl] 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid [2-(2-iodoanilino)-2-keto-ethyl] ester Formula: C13H12IN3O4 MolecularWeight: 401.15655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC=C2I)N

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC=C2I)N

InChI

InChI=1S/C13H12IN3O4/c1-7-11(12(15)21-17-7)13(19)20-6-10(18)16-9-5-3-2-4-8(9)14/h2-5H,6,15H2,1H3,(H,16,18)