2-[(2-chloranyl-9H-xanthen-9-yl)sulfonyl]benzoic acid

Systemtic Name: 2-[(2-chloranyl-9H-xanthen-9-yl)sulfonyl]benzoic acid Openeye Name: 2-[(2-chloro-9H-xanthen-9-yl)sulfonyl]benzoic acid CAS Name: 2-[(2-chloro-9H-xanthen-9-yl)sulfonyl]benzoic acid IUPAC Name: 2-[(2-chloro-9H-xanthen-9-yl)sulfonyl]benzoic acid Traditional Name: 2-[(2-chloro-9H-xanthen-9-yl)sulfonyl]benzoic acid Formula: C20H13ClO5S MolecularWeight: 400.83222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C20H13ClO5S/c21-12-9-10-17-15(11-12)19(13-5-1-3-7-16(13)26-17)27(24,25)18-8-4-2-6-14(18)20(22)23/h1-11,19H,(H,22,23)