butyl 9-oxidanylidenethioxanthene-1-carboxylate

Systemtic Name: butyl 9-oxidanylidenethioxanthene-1-carboxylate Openeye Name: butyl 9-oxothioxanthene-1-carboxylate CAS Name: 9-oxo-1-thioxanthenecarboxylic acid butyl ester IUPAC Name: butyl 9-oxothioxanthene-1-carboxylate Traditional Name: 9-ketothioxanthene-1-carboxylic acid butyl ester Formula: C18H16O3S MolecularWeight: 312.38284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C2C(=CC=C1)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCOC(=O)C1=C2C(=CC=C1)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H16O3S/c1-2-3-11-21-18(20)13-8-6-10-15-16(13)17(19)12-7-4-5-9-14(12)22-15/h4-10H,2-3,11H2,1H3