methyl 5-bromanyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]benzoate Openeye Name: methyl 5-bromo-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]benzoate CAS Name: 5-bromo-2-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]benzoate Traditional Name: 5-bromo-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]benzoic acid methyl ester Formula: C13H13BrN2O5S MolecularWeight: 389.22172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C13H13BrN2O5S/c1-7-12(8(2)21-15-7)22(18,19)16-11-5-4-9(14)6-10(11)13(17)20-3/h4-6,16H,1-3H3