7-[(2-methylpropan-2-yl)oxy]-5-methylsulfanyl-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-[(2-methylpropan-2-yl)oxy]-5-methylsulfanyl-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-tert-butoxy-5-methylsulfanyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-[(2-methylpropan-2-yl)oxy]-5-(methylthio)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-[(2-methylpropan-2-yl)oxy]-5-methylsulfanyl-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-tert-butoxy-9-keto-5-(methylthio)xanthene-2-carboxylic acid Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)SC

Isomeric SMILES

CC(C)(C)OC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)SC

InChI

InChI=1S/C19H18O5S/c1-19(2,3)24-11-8-13-16(20)12-7-10(18(21)22)5-6-14(12)23-17(13)15(9-11)25-4/h5-9H,1-4H3,(H,21,22)