phenyl 1-acetamido-3-oxidanylidene-1,4-diphenyl-butane-2-sulfonate

Systemtic Name: phenyl 1-acetamido-3-oxidanylidene-1,4-diphenyl-butane-2-sulfonate Openeye Name: phenyl 1-acetamido-3-oxo-1,4-diphenyl-butane-2-sulfonate CAS Name: 1-acetamido-3-oxo-1,4-diphenyl-2-butanesulfonic acid IUPAC Name: phenyl 1-acetamido-3-oxo-1,4-diphenylbutane-2-sulfonate Traditional Name: 1-acetamido-3-keto-1,4-diphenyl-butane-2-sulfonic acid phenyl ester Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CC=C1)C(C(=O)CC2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(C1=CC=CC=C1)C(C(=O)CC2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C24H23NO5S/c1-18(26)25-23(20-13-7-3-8-14-20)24(22(27)17-19-11-5-2-6-12-19)31(28,29)30-21-15-9-4-10-16-21/h2-16,23-24H,17H2,1H3,(H,25,26)