2-(9H-xanthen-9-ylsulfanyl)ethanoate

Systemtic Name: 2-(9H-xanthen-9-ylsulfanyl)ethanoate Openeye Name: 2-(9H-xanthen-9-ylsulfanyl)acetate CAS Name: 2-(9H-xanthen-9-ylthio)acetate IUPAC Name: 2-(9H-xanthen-9-ylsulfanyl)acetate Traditional Name: 2-(9H-xanthen-9-ylthio)acetate Formula: C15H11O3S- MolecularWeight: 271.31104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)SCC(=O)[O-]

InChI

InChI=1S/C15H12O3S/c16-14(17)9-19-15-10-5-1-3-7-12(10)18-13-8-4-2-6-11(13)15/h1-8,15H,9H2,(H,16,17)/p-1