9-oxidanylidene-7-(2-oxidanylpropylsulfanyl)xanthene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-7-(2-oxidanylpropylsulfanyl)xanthene-2-carboxylic acid Openeye Name: 7-(2-hydroxypropylsulfanyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-(2-hydroxypropylthio)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-(2-hydroxypropylsulfanyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-(2-hydroxypropylthio)-9-keto-xanthene-2-carboxylic acid Formula: C17H14O5S MolecularWeight: 330.35506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC2=C(C=C1)OC3=C(C2=O)C=C(C=C3)C(=O)O)O

Isomeric SMILES

CC(CSC1=CC2=C(C=C1)OC3=C(C2=O)C=C(C=C3)C(=O)O)O

InChI

InChI=1S/C17H14O5S/c1-9(18)8-23-11-3-5-15-13(7-11)16(19)12-6-10(17(20)21)2-4-14(12)22-15/h2-7,9,18H,8H2,1H3,(H,20,21)