[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]azanium

Systemtic Name: [1-(2-phenylsulfanylethanoyl)piperidin-4-yl]azanium Openeye Name: [1-(2-phenylsulfanylacetyl)-4-piperidyl]ammonium CAS Name: [1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]ammonium IUPAC Name: [1-(2-phenylsulfanylacetyl)piperidin-4-yl]azanium Traditional Name: [1-[2-(phenylthio)acetyl]-4-piperidyl]ammonium Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH3+])C(=O)CSC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1[NH3+])C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C13H18N2OS/c14-11-6-8-15(9-7-11)13(16)10-17-12-4-2-1-3-5-12/h1-5,11H,6-10,14H2/p+1