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

Systemtic Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone CAS Name: [(3S)-1-cyclopentyl-3-piperidin-1-iumyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-[2-(methylthio)phenyl]methanone Formula: C18H26NOS+ MolecularWeight: 304.47014

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCC[NH+](C2)C3CCCC3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)[C@H]2CCC[NH+](C2)C3CCCC3

InChI

InChI=1S/C18H25NOS/c1-21-17-11-5-4-10-16(17)18(20)14-7-6-12-19(13-14)15-8-2-3-9-15/h4-5,10-11,14-15H,2-3,6-9,12-13H2,1H3/p+1/t14-/m0/s1