methyl (2S)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]propanoate

Systemtic Name: methyl (2S)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]propanoate Openeye Name: methyl (2S)-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propanoate CAS Name: (2S)-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoate Traditional Name: (2S)-2-[[2-(tosylamino)acetyl]amino]propionic acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)N[C@@H](C)C(=O)OC

InChI

InChI=1S/C13H18N2O5S/c1-9-4-6-11(7-5-9)21(18,19)14-8-12(16)15-10(2)13(17)20-3/h4-7,10,14H,8H2,1-3H3,(H,15,16)/t10-/m0/s1