7-cyclopentyl-5-methylsulfanyl-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-cyclopentyl-5-methylsulfanyl-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-cyclopentyl-5-methylsulfanyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-cyclopentyl-5-(methylthio)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-cyclopentyl-5-methylsulfanyl-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-cyclopentyl-9-keto-5-(methylthio)xanthene-2-carboxylic acid Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(=CC(=C1)C3CCCC3)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

Isomeric SMILES

CSC1=C2C(=CC(=C1)C3CCCC3)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

InChI

InChI=1S/C20H18O4S/c1-25-17-10-13(11-4-2-3-5-11)9-15-18(21)14-8-12(20(22)23)6-7-16(14)24-19(15)17/h6-11H,2-5H2,1H3,(H,22,23)