(4-methylphenyl)methyl (2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl (2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate Openeye Name: p-tolylmethyl (2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-2-pyrrolidinecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl (2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonylpyrrolidine-2-carboxylic acid (4-methylbenzyl) ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2CCCN2S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)[C@@H]2CCCN2S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H22N2O5S/c1-12-6-8-15(9-7-12)11-24-18(21)16-5-4-10-20(16)26(22,23)17-13(2)19-25-14(17)3/h6-9,16H,4-5,10-11H2,1-3H3/t16-/m0/s1