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

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C13H12BrN3O4 MolecularWeight: 354.15608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC(=CC=C2)Br)N

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC(=CC=C2)Br)N

InChI

InChI=1S/C13H12BrN3O4/c1-7-11(12(15)21-17-7)13(19)20-6-10(18)16-9-4-2-3-8(14)5-9/h2-5H,6,15H2,1H3,(H,16,18)