9-oxidanylidene-7-propoxy-thioxanthene-3-carboxylic acid

Systemtic Name: 9-oxidanylidene-7-propoxy-thioxanthene-3-carboxylic acid Openeye Name: 9-oxo-7-propoxy-thioxanthene-3-carboxylic acid CAS Name: 9-oxo-7-propoxy-3-thioxanthenecarboxylic acid IUPAC Name: 9-oxo-7-propoxythioxanthene-3-carboxylic acid Traditional Name: 9-keto-7-propoxy-thioxanthene-3-carboxylic acid Formula: C17H14O4S MolecularWeight: 314.35566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCOC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)C(=O)O

InChI

InChI=1S/C17H14O4S/c1-2-7-21-11-4-6-14-13(9-11)16(18)12-5-3-10(17(19)20)8-15(12)22-14/h3-6,8-9H,2,7H2,1H3,(H,19,20)