2-(naphthalen-1-ylmethylsulfanyl)ethanoic acid

Systemtic Name: 2-(naphthalen-1-ylmethylsulfanyl)ethanoic acid Openeye Name: 2-(1-naphthylmethylsulfanyl)acetic acid CAS Name: 2-(1-naphthalenylmethylthio)acetic acid IUPAC Name: 2-(naphthalen-1-ylmethylsulfanyl)acetic acid Traditional Name: 2-(1-naphthylmethylthio)acetic acid Formula: C13H12O2S MolecularWeight: 232.29818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)O

InChI

InChI=1S/C13H12O2S/c14-13(15)9-16-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9H2,(H,14,15)