3-[(4-methylphenyl)methyl-methylsulfonyl-amino]propanoate

Systemtic Name: 3-[(4-methylphenyl)methyl-methylsulfonyl-amino]propanoate Openeye Name: 3-[methylsulfonyl(p-tolylmethyl)amino]propanoate CAS Name: 3-[(4-methylphenyl)methyl-methylsulfonylamino]propanoate IUPAC Name: 3-[(4-methylphenyl)methyl-methylsulfonylamino]propanoate Traditional Name: 3-[mesyl-(4-methylbenzyl)amino]propionate Formula: C12H16NO4S- MolecularWeight: 270.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C12H17NO4S/c1-10-3-5-11(6-4-10)9-13(18(2,16)17)8-7-12(14)15/h3-6H,7-9H2,1-2H3,(H,14,15)/p-1