2-[[2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[3-hydroxy-2-(p-tolylsulfonylamino)propanoyl]amino]acetic acid CAS Name: 2-[[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]acetic acid Traditional Name: 2-[[3-hydroxy-2-(tosylamino)propanoyl]amino]acetic acid Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O6S/c1-8-2-4-9(5-3-8)21(19,20)14-10(7-15)12(18)13-6-11(16)17/h2-5,10,14-15H,6-7H2,1H3,(H,13,18)(H,16,17)