2-(ethanoylsulfanylmethyl)-3-naphthalen-2-yl-butanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-3-naphthalen-2-yl-butanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-(2-naphthyl)butanoic acid CAS Name: 2-[(acetylthio)methyl]-3-(2-naphthalenyl)butanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-3-naphthalen-2-ylbutanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-(2-naphthyl)butyric acid Formula: C17H18O3S MolecularWeight: 302.38802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)C(CSC(=O)C)C(=O)O

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=C1)C(CSC(=O)C)C(=O)O

InChI

InChI=1S/C17H18O3S/c1-11(16(17(19)20)10-21-12(2)18)14-8-7-13-5-3-4-6-15(13)9-14/h3-9,11,16H,10H2,1-2H3,(H,19,20)