1-[(1R)-2-methyl-1-phenylsulfanyl-propyl]pyrrolidin-1-ium

Systemtic Name: 1-[(1R)-2-methyl-1-phenylsulfanyl-propyl]pyrrolidin-1-ium Openeye Name: 1-[(1R)-2-methyl-1-phenylsulfanyl-propyl]pyrrolidin-1-ium CAS Name: 1-[(1R)-2-methyl-1-(phenylthio)propyl]pyrrolidin-1-ium IUPAC Name: 1-[(1R)-2-methyl-1-phenylsulfanylpropyl]pyrrolidin-1-ium Traditional Name: 1-[(1R)-2-methyl-1-(phenylthio)propyl]pyrrolidin-1-ium Formula: C14H22NS+ MolecularWeight: 236.39618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C([NH+]1CCCC1)SC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@H]([NH+]1CCCC1)SC2=CC=CC=C2

InChI

InChI=1S/C14H21NS/c1-12(2)14(15-10-6-7-11-15)16-13-8-4-3-5-9-13/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3/p+1/t14-/m1/s1