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

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-phenyl-propanoate Openeye Name: 3-hydroxy-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: 3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate IUPAC Name: 3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 3-hydroxy-3-phenyl-2-(tosylamino)propionate Formula: C16H16NO5S- MolecularWeight: 334.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C2=CC=CC=C2)O)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C2=CC=CC=C2)O)C(=O)[O-]

InChI

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