2-(9H-xanthen-9-ylsulfanyl)ethanoic acid

Systemtic Name: 2-(9H-xanthen-9-ylsulfanyl)ethanoic acid Openeye Name: 2-(9H-xanthen-9-ylsulfanyl)acetic acid CAS Name: 2-(9H-xanthen-9-ylthio)acetic acid IUPAC Name: 2-(9H-xanthen-9-ylsulfanyl)acetic acid Traditional Name: 2-(9H-xanthen-9-ylthio)acetic acid Formula: C15H12O3S MolecularWeight: 272.31898

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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)