phenyl 3-acetamido-2-(2-hydroxyphenyl)-1-oxidanylidene-3-phenyl-propane-1-sulfonate

Systemtic Name: phenyl 3-acetamido-2-(2-hydroxyphenyl)-1-oxidanylidene-3-phenyl-propane-1-sulfonate Openeye Name: phenyl 3-acetamido-2-(2-hydroxyphenyl)-1-oxo-3-phenyl-propane-1-sulfonate CAS Name: 3-acetamido-2-(2-hydroxyphenyl)-1-oxo-3-phenyl-1-propanesulfonic acid IUPAC Name: phenyl 3-acetamido-2-(2-hydroxyphenyl)-1-oxo-3-phenylpropane-1-sulfonate Traditional Name: 3-acetamido-2-(2-hydroxyphenyl)-1-keto-3-phenyl-propane-1-sulfonic acid phenyl ester Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C23H21NO6S/c1-16(25)24-22(17-10-4-2-5-11-17)21(19-14-8-9-15-20(19)26)23(27)31(28,29)30-18-12-6-3-7-13-18/h2-15,21-22,26H,1H3,(H,24,25)