2-[3,6-bis(chloranyl)-9H-xanthen-9-yl]benzenesulfonic acid

Systemtic Name: 2-[3,6-bis(chloranyl)-9H-xanthen-9-yl]benzenesulfonic acid Openeye Name: 2-(3,6-dichloro-9H-xanthen-9-yl)benzenesulfonic acid CAS Name: 2-(3,6-dichloro-9H-xanthen-9-yl)benzenesulfonic acid IUPAC Name: 2-(3,6-dichloro-9H-xanthen-9-yl)benzenesulfonic acid Traditional Name: 2-(3,6-dichloro-9H-xanthen-9-yl)besylic acid Formula: C19H12Cl2O4S MolecularWeight: 407.26718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C3=C(C=C(C=C3)Cl)OC4=C2C=CC(=C4)Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2C3=C(C=C(C=C3)Cl)OC4=C2C=CC(=C4)Cl)S(=O)(=O)O

InChI

InChI=1S/C19H12Cl2O4S/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/h1-10,19H,(H,22,23,24)