methyl 4-(2-naphthalen-2-ylsulfanylethanoyloxymethyl)benzoate

Systemtic Name: methyl 4-(2-naphthalen-2-ylsulfanylethanoyloxymethyl)benzoate Openeye Name: methyl 4-[[2-(2-naphthylsulfanyl)acetyl]oxymethyl]benzoate CAS Name: 4-[[2-(2-naphthalenylthio)-1-oxoethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-naphthalen-2-ylsulfanylacetyl)oxymethyl]benzoate Traditional Name: 4-[[2-(2-naphthylthio)acetyl]oxymethyl]benzoic acid methyl ester Formula: C21H18O4S MolecularWeight: 366.43022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H18O4S/c1-24-21(23)17-8-6-15(7-9-17)13-25-20(22)14-26-19-11-10-16-4-2-3-5-18(16)12-19/h2-12H,13-14H2,1H3