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

Systemtic Name: phenyl 1-(2-hydroxyphenyl)-1-oxidanylidene-3-phenyl-3-(phenylsulfonylcarbonylamino)propane-2-sulfonate Openeye Name: phenyl 1-(benzenesulfonylcarbonylamino)-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propane-2-sulfonate CAS Name: 1-[[benzenesulfonyl(oxo)methyl]amino]-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-2-propanesulfonic acid IUPAC Name: phenyl 1-(benzenesulfonylcarbonylamino)-3-(2-hydroxyphenyl)-3-oxo-1-phenylpropane-2-sulfonate Traditional Name: 1-(besylcarbonylamino)-3-(2-hydroxyphenyl)-3-keto-1-phenyl-propane-2-sulfonic acid phenyl ester Formula: C28H23NO8S2 MolecularWeight: 565.61412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)C2=CC=CC=C2O)S(=O)(=O)OC3=CC=CC=C3)NC(=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)C2=CC=CC=C2O)S(=O)(=O)OC3=CC=CC=C3)NC(=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H23NO8S2/c30-24-19-11-10-18-23(24)26(31)27(39(35,36)37-21-14-6-2-7-15-21)25(20-12-4-1-5-13-20)29-28(32)38(33,34)22-16-8-3-9-17-22/h1-19,25,27,30H,(H,29,32)