[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-[(4-bromophenyl)carbonylamino]benzoate

Systemtic Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-[(4-bromophenyl)carbonylamino]benzoate Openeye Name: [2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 3-[(4-bromobenzoyl)amino]benzoate CAS Name: 3-[[(4-bromophenyl)-oxomethyl]amino]benzoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-[(4-bromobenzoyl)amino]benzoate Traditional Name: 3-[(4-bromobenzoyl)amino]benzoic acid [2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C20H16BrN3O5 MolecularWeight: 458.26214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H16BrN3O5/c1-12-9-17(24-29-12)23-18(25)11-28-20(27)14-3-2-4-16(10-14)22-19(26)13-5-7-15(21)8-6-13/h2-10H,11H2,1H3,(H,22,26)(H,23,24,25)