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

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (5-methylisoxazol-3-yl)methyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (5-methylisoxazol-3-yl)methyl ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NOC(=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NOC(=C2)C

InChI

InChI=1S/C15H18N2O5S/c1-11-3-5-14(6-4-11)23(19,20)16-8-7-15(18)21-10-13-9-12(2)22-17-13/h3-6,9,16H,7-8,10H2,1-2H3