methyl (2S)-2-[[(2R)-3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propanoyl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[(2R)-2-hydroxy-3-(p-tolylsulfonylamino)propanoyl]amino]propanoate CAS Name: (2S)-2-[[(2R)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]propanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2R)-2-hydroxy-3-(tosylamino)propanoyl]amino]propionic acid methyl ester Formula: C14H20N2O6S MolecularWeight: 344.3834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O6S/c1-9-4-6-11(7-5-9)23(20,21)15-8-12(17)13(18)16-10(2)14(19)22-3/h4-7,10,12,15,17H,8H2,1-3H3,(H,16,18)/t10-,12+/m0/s1