(2-oxidanyl-3-oxidanylidene-2-phenyl-1H-inden-1-yl) 4-chloranylbenzenesulfonate

Systemtic Name: (2-oxidanyl-3-oxidanylidene-2-phenyl-1H-inden-1-yl) 4-chloranylbenzenesulfonate Openeye Name: (2-hydroxy-3-oxo-2-phenyl-indan-1-yl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (2-hydroxy-3-oxo-2-phenyl-1H-inden-1-yl) ester IUPAC Name: (2-hydroxy-3-oxo-2-phenyl-1H-inden-1-yl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2-hydroxy-3-keto-2-phenyl-indan-1-yl) ester Formula: C21H15ClO5S MolecularWeight: 414.8588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(C3=CC=CC=C3C2=O)OS(=O)(=O)C4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(C3=CC=CC=C3C2=O)OS(=O)(=O)C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C21H15ClO5S/c22-15-10-12-16(13-11-15)28(25,26)27-20-18-9-5-4-8-17(18)19(23)21(20,24)14-6-2-1-3-7-14/h1-13,20,24H