(4-bromanyl-2-chloranyl-phenyl) 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate Openeye Name: (4-bromo-2-chloro-phenyl) 1-(3,5-dimethylisoxazol-4-yl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-2-pyrrolidinecarboxylic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonylpyrrolidine-2-carboxylic acid (4-bromo-2-chloro-phenyl) ester Formula: C16H16BrClN2O5S MolecularWeight: 463.73064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC2C(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC2C(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H16BrClN2O5S/c1-9-15(10(2)25-19-9)26(22,23)20-7-3-4-13(20)16(21)24-14-6-5-11(17)8-12(14)18/h5-6,8,13H,3-4,7H2,1-2H3