[(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone CAS Name: [(3S)-1-cyclobutyl-3-piperidin-1-iumyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-[2-(methylthio)phenyl]methanone Formula: C17H24NOS+ MolecularWeight: 290.44356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCC[NH+](C2)C3CCC3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)[C@H]2CCC[NH+](C2)C3CCC3

InChI

InChI=1S/C17H23NOS/c1-20-16-10-3-2-9-15(16)17(19)13-6-5-11-18(12-13)14-7-4-8-14/h2-3,9-10,13-14H,4-8,11-12H2,1H3/p+1/t13-/m0/s1