azetidin-1-yl-[(2S,4S)-4-[(4-methoxyphenyl)methylsulfanyl]-1,1-dimethyl-pyrrolidin-1-ium-2-yl]methanone

Systemtic Name: azetidin-1-yl-[(2S,4S)-4-[(4-methoxyphenyl)methylsulfanyl]-1,1-dimethyl-pyrrolidin-1-ium-2-yl]methanone Openeye Name: azetidin-1-yl-[(2S,4S)-4-[(4-methoxyphenyl)methylsulfanyl]-1,1-dimethyl-pyrrolidin-1-ium-2-yl]methanone CAS Name: 1-azetidinyl-[(2S,4S)-4-[(4-methoxyphenyl)methylthio]-1,1-dimethyl-2-pyrrolidin-1-iumyl]methanone IUPAC Name: azetidin-1-yl-[(2S,4S)-4-[(4-methoxyphenyl)methylsulfanyl]-1,1-dimethylpyrrolidin-1-ium-2-yl]methanone Traditional Name: azetidin-1-yl-[(2S,4S)-1,1-dimethyl-4-(p-anisylthio)pyrrolidin-1-ium-2-yl]methanone Formula: C18H27N2O2S+ MolecularWeight: 335.48418

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(CC1C(=O)N2CCC2)SCC3=CC=C(C=C3)OC)C

Isomeric SMILES

C[N+]1(C[C@H](C[C@H]1C(=O)N2CCC2)SCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H27N2O2S/c1-20(2)12-16(11-17(20)18(21)19-9-4-10-19)23-13-14-5-7-15(22-3)8-6-14/h5-8,16-17H,4,9-13H2,1-3H3/q+1/t16-,17-/m0/s1