5-methyl-9-oxidanylidene-7-propan-2-ylsulfinyl-xanthene-2-carboxylic acid

Systemtic Name: 5-methyl-9-oxidanylidene-7-propan-2-ylsulfinyl-xanthene-2-carboxylic acid Openeye Name: 7-isopropylsulfinyl-5-methyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-methyl-9-oxo-7-propan-2-ylsulfinyl-2-xanthenecarboxylic acid IUPAC Name: 5-methyl-9-oxo-7-propan-2-ylsulfinylxanthene-2-carboxylic acid Traditional Name: 7-isopropylsulfinyl-9-keto-5-methyl-xanthene-2-carboxylic acid Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)C(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)C(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C18H16O5S/c1-9(2)24(22)12-6-10(3)17-14(8-12)16(19)13-7-11(18(20)21)4-5-15(13)23-17/h4-9H,1-3H3,(H,20,21)