4-[[1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]methyl]benzenesulfonic acid

Systemtic Name: 4-[[1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]methyl]benzenesulfonic acid Openeye Name: 4-[(1,3-dioxo-2-phenyl-indan-2-yl)methyl]benzenesulfonic acid CAS Name: 4-[(1,3-dioxo-2-phenyl-2-indenyl)methyl]benzenesulfonic acid IUPAC Name: 4-[(1,3-dioxo-2-phenylinden-2-yl)methyl]benzenesulfonic acid Traditional Name: 4-[(1,3-diketo-2-phenyl-indan-2-yl)methyl]besylic acid Formula: C22H16O5S MolecularWeight: 392.42444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2=O)CC4=CC=C(C=C4)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2=O)CC4=CC=C(C=C4)S(=O)(=O)O

InChI

InChI=1S/C22H16O5S/c23-20-18-8-4-5-9-19(18)21(24)22(20,16-6-2-1-3-7-16)14-15-10-12-17(13-11-15)28(25,26)27/h1-13H,14H2,(H,25,26,27)