phenyl 1-oxidanylidene-2,3-diphenyl-3-(propanoylamino)propane-1-sulfonate

Systemtic Name: phenyl 1-oxidanylidene-2,3-diphenyl-3-(propanoylamino)propane-1-sulfonate Openeye Name: phenyl 1-oxo-2,3-diphenyl-3-(propanoylamino)propane-1-sulfonate CAS Name: 1-oxo-3-(1-oxopropylamino)-2,3-diphenyl-1-propanesulfonic acid IUPAC Name: phenyl 1-oxo-2,3-diphenyl-3-(propanoylamino)propane-1-sulfonate Traditional Name: 1-keto-2,3-diphenyl-3-propionamido-propane-1-sulfonic acid phenyl ester Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23NO5S/c1-2-21(26)25-23(19-14-8-4-9-15-19)22(18-12-6-3-7-13-18)24(27)31(28,29)30-20-16-10-5-11-17-20/h3-17,22-23H,2H2,1H3,(H,25,26)