1-(3-methoxyphenyl)sulfanyl-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(3-methoxyphenyl)sulfanyl-3,3-dimethyl-butan-2-one Openeye Name: 1-(3-methoxyphenyl)sulfanyl-3,3-dimethyl-butan-2-one CAS Name: 1-[(3-methoxyphenyl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-(3-methoxyphenyl)sulfanyl-3,3-dimethylbutan-2-one Traditional Name: 1-[(3-methoxyphenyl)thio]-3,3-dimethyl-butan-2-one Formula: C13H18O2S MolecularWeight: 238.34582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=CC=CC(=C1)OC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=CC=CC(=C1)OC

InChI

InChI=1S/C13H18O2S/c1-13(2,3)12(14)9-16-11-7-5-6-10(8-11)15-4/h5-8H,9H2,1-4H3