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

Systemtic Name: butyl 7-methyl-9-oxidanylidene-thioxanthene-3-carboxylate Openeye Name: butyl 7-methyl-9-oxo-thioxanthene-3-carboxylate CAS Name: 7-methyl-9-oxo-3-thioxanthenecarboxylic acid butyl ester IUPAC Name: butyl 7-methyl-9-oxothioxanthene-3-carboxylate Traditional Name: 9-keto-7-methyl-thioxanthene-3-carboxylic acid butyl ester Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=C(S2)C=CC(=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=C(S2)C=CC(=C3)C

InChI

InChI=1S/C19H18O3S/c1-3-4-9-22-19(21)13-6-7-14-17(11-13)23-16-8-5-12(2)10-15(16)18(14)20/h5-8,10-11H,3-4,9H2,1-2H3