2-naphtho[1,2-b][1]benzothiol-5-ylsulfanylethanoic acid

Systemtic Name: 2-naphtho[1,2-b][1]benzothiol-5-ylsulfanylethanoic acid Openeye Name: 2-naphtho[1,2-b]benzothiophen-5-ylsulfanylacetic acid CAS Name: 2-(5-naphtho[1,2-b][1]benzothiolylthio)acetic acid IUPAC Name: 2-naphtho[1,2-b][1]benzothiol-5-ylsulfanylacetic acid Traditional Name: 2-(naphtho[1,2-b]benzothiophen-5-ylthio)acetic acid Formula: C18H12O2S2 MolecularWeight: 324.41668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=C2SC4=CC=CC=C43)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC3=C2SC4=CC=CC=C43)SCC(=O)O

InChI

InChI=1S/C18H12O2S2/c19-17(20)10-21-16-9-14-12-6-3-4-8-15(12)22-18(14)13-7-2-1-5-11(13)16/h1-9H,10H2,(H,19,20)