4-(6-methylnaphthalen-2-yl)-2-methylsulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(6-methylnaphthalen-2-yl)-2-methylsulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(6-methyl-2-naphthyl)-2-methylsulfanyl-4-oxo-butanoic acid CAS Name: 4-(6-methyl-2-naphthalenyl)-2-(methylthio)-4-oxobutanoic acid IUPAC Name: 4-(6-methylnaphthalen-2-yl)-2-methylsulfanyl-4-oxobutanoic acid Traditional Name: 4-keto-4-(6-methyl-2-naphthyl)-2-(methylthio)butyric acid Formula: C16H16O3S MolecularWeight: 288.36144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C=C2)C(=O)CC(C(=O)O)SC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C=C2)C(=O)CC(C(=O)O)SC

InChI

InChI=1S/C16H16O3S/c1-10-3-4-12-8-13(6-5-11(12)7-10)14(17)9-15(20-2)16(18)19/h3-8,15H,9H2,1-2H3,(H,18,19)