methyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]ethanoate

Systemtic Name: methyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]ethanoate Openeye Name: methyl 2-[3-(p-tolylsulfonyl)propanoylamino]acetate CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]acetate Traditional Name: 2-(3-tosylpropanoylamino)acetic acid methyl ester Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC(=O)OC

InChI

InChI=1S/C13H17NO5S/c1-10-3-5-11(6-4-10)20(17,18)8-7-12(15)14-9-13(16)19-2/h3-6H,7-9H2,1-2H3,(H,14,15)