3-(naphthalen-2-ylsulfanylmethyl)benzoic acid

Systemtic Name: 3-(naphthalen-2-ylsulfanylmethyl)benzoic acid Openeye Name: 3-(2-naphthylsulfanylmethyl)benzoic acid CAS Name: 3-[(2-naphthalenylthio)methyl]benzoic acid IUPAC Name: 3-(naphthalen-2-ylsulfanylmethyl)benzoic acid Traditional Name: 3-[(2-naphthylthio)methyl]benzoic acid Formula: C18H14O2S MolecularWeight: 294.36756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C18H14O2S/c19-18(20)16-7-3-4-13(10-16)12-21-17-9-8-14-5-1-2-6-15(14)11-17/h1-11H,12H2,(H,19,20)