3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-3-phenyl-propanoic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-3-phenyl-propanoic acid Openeye Name: 2-hydroxy-3-phenyl-3-(p-tolylsulfonylamino)propanoic acid CAS Name: 2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-hydroxy-3-phenyl-3-(tosylamino)propionic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C(=O)O)O

InChI

InChI=1S/C16H17NO5S/c1-11-7-9-13(10-8-11)23(21,22)17-14(15(18)16(19)20)12-5-3-2-4-6-12/h2-10,14-15,17-18H,1H3,(H,19,20)