2-(3-oxidanyl-6-oxidanylidene-thioxanthen-9-yl)benzenesulfonic acid

Systemtic Name: 2-(3-oxidanyl-6-oxidanylidene-thioxanthen-9-yl)benzenesulfonic acid Openeye Name: 2-(3-hydroxy-6-oxo-thioxanthen-9-yl)benzenesulfonic acid CAS Name: 2-(3-hydroxy-6-oxo-9-thioxanthenyl)benzenesulfonic acid IUPAC Name: 2-(3-hydroxy-6-oxothioxanthen-9-yl)benzenesulfonic acid Traditional Name: 2-(3-hydroxy-6-keto-thioxanthen-9-yl)besylic acid Formula: C19H12O5S2 MolecularWeight: 384.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC(=O)C=C3SC4=C2C=CC(=C4)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC(=O)C=C3SC4=C2C=CC(=C4)O)S(=O)(=O)O

InChI

InChI=1S/C19H12O5S2/c20-11-5-7-13-16(9-11)25-17-10-12(21)6-8-14(17)19(13)15-3-1-2-4-18(15)26(22,23)24/h1-10,20H,(H,22,23,24)