(3,5-dimethyl-1,2-oxazol-4-yl)methyl (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propionic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C(C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)[C@H](C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C17H21N3O6S/c1-10-16(12(3)26-19-10)9-25-17(22)11(2)20-27(23,24)15-7-5-14(6-8-15)18-13(4)21/h5-8,11,20H,9H2,1-4H3,(H,18,21)/t11-/m0/s1