2,4-dimethyl-9-oxidanylidene-thioxanthene-3-carboxylic acid

Systemtic Name: 2,4-dimethyl-9-oxidanylidene-thioxanthene-3-carboxylic acid Openeye Name: 2,4-dimethyl-9-oxo-thioxanthene-3-carboxylic acid CAS Name: 2,4-dimethyl-9-oxo-3-thioxanthenecarboxylic acid IUPAC Name: 2,4-dimethyl-9-oxothioxanthene-3-carboxylic acid Traditional Name: 9-keto-2,4-dimethyl-thioxanthene-3-carboxylic acid Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3S2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3S2)C)C(=O)O

InChI

InChI=1S/C16H12O3S/c1-8-7-11-14(17)10-5-3-4-6-12(10)20-15(11)9(2)13(8)16(18)19/h3-7H,1-2H3,(H,18,19)