2-(9H-xanthen-9-yl)ethanethioic S-acid

Systemtic Name: 2-(9H-xanthen-9-yl)ethanethioic S-acid Openeye Name: 2-(9H-xanthen-9-yl)ethanethioic S-acid CAS Name: 2-(9H-xanthen-9-yl)ethanethioic S-acid IUPAC Name: 2-(9H-xanthen-9-yl)ethanethioic S-acid Traditional Name: 2-(9H-xanthen-9-yl)thioacetic acid Formula: C15H12O2S MolecularWeight: 256.31958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)CC(=O)S

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)CC(=O)S

InChI

InChI=1S/C15H12O2S/c16-15(18)9-12-10-5-1-3-7-13(10)17-14-8-4-2-6-11(12)14/h1-8,12H,9H2,(H,16,18)