7-chloranylsulfonyl-5-ethyl-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-chloranylsulfonyl-5-ethyl-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-chlorosulfonyl-5-ethyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-chlorosulfonyl-5-ethyl-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-chlorosulfonyl-5-ethyl-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-chlorosulfonyl-5-ethyl-9-keto-xanthene-2-carboxylic acid Formula: C16H11ClO6S MolecularWeight: 366.77294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)S(=O)(=O)Cl)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCC1=C2C(=CC(=C1)S(=O)(=O)Cl)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C16H11ClO6S/c1-2-8-5-10(24(17,21)22)7-12-14(18)11-6-9(16(19)20)3-4-13(11)23-15(8)12/h3-7H,2H2,1H3,(H,19,20)