2-(naphthalen-1-ylmethyl)-5-sulfanyl-pentanoic acid

Systemtic Name: 2-(naphthalen-1-ylmethyl)-5-sulfanyl-pentanoic acid Openeye Name: 2-(1-naphthylmethyl)-5-sulfanyl-pentanoic acid CAS Name: 5-mercapto-2-(1-naphthalenylmethyl)pentanoic acid IUPAC Name: 2-(naphthalen-1-ylmethyl)-5-sulfanylpentanoic acid Traditional Name: 5-mercapto-2-(1-naphthylmethyl)valeric acid Formula: C16H18O2S MolecularWeight: 274.37792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(CCCS)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(CCCS)C(=O)O

InChI

InChI=1S/C16H18O2S/c17-16(18)14(8-4-10-19)11-13-7-3-6-12-5-1-2-9-15(12)13/h1-3,5-7,9,14,19H,4,8,10-11H2,(H,17,18)