methyl 7-methyl-9-oxidanylidene-thioxanthene-3-carboxylate

Systemtic Name: methyl 7-methyl-9-oxidanylidene-thioxanthene-3-carboxylate Openeye Name: methyl 7-methyl-9-oxo-thioxanthene-3-carboxylate CAS Name: 7-methyl-9-oxo-3-thioxanthenecarboxylic acid methyl ester IUPAC Name: methyl 7-methyl-9-oxothioxanthene-3-carboxylate Traditional Name: 9-keto-7-methyl-thioxanthene-3-carboxylic acid methyl ester Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)C(=O)OC

InChI

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