2-(9-phenylthioxanthen-9-yl)ethanoic acid

Systemtic Name: 2-(9-phenylthioxanthen-9-yl)ethanoic acid Openeye Name: 2-(9-phenylthioxanthen-9-yl)acetic acid CAS Name: 2-(9-phenyl-9-thioxanthenyl)acetic acid IUPAC Name: 2-(9-phenylthioxanthen-9-yl)acetic acid Traditional Name: 2-(9-phenylthioxanthen-9-yl)acetic acid Formula: C21H16O2S MolecularWeight: 332.41554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=CC=CC=C3SC4=CC=CC=C42)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=CC=CC=C3SC4=CC=CC=C42)CC(=O)O

InChI

InChI=1S/C21H16O2S/c22-20(23)14-21(15-8-2-1-3-9-15)16-10-4-6-12-18(16)24-19-13-7-5-11-17(19)21/h1-13H,14H2,(H,22,23)