butyl 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate

Systemtic Name: butyl 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate Openeye Name: butyl 9,10,10-trioxothioxanthene-3-carboxylate CAS Name: 9,10,10-trioxo-3-thioxanthenecarboxylic acid butyl ester IUPAC Name: butyl 9,10,10-trioxothioxanthene-3-carboxylate Traditional Name: 9,10,10-triketothioxanthene-3-carboxylic acid butyl ester Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C18H16O5S/c1-2-3-10-23-18(20)12-8-9-14-16(11-12)24(21,22)15-7-5-4-6-13(15)17(14)19/h4-9,11H,2-3,10H2,1H3