3-[(4-methoxyphenyl)methylsulfanyl]-N,N,1-trimethyl-pyrrolidin-1-ium-1-carboxamide

Systemtic Name: 3-[(4-methoxyphenyl)methylsulfanyl]-N,N,1-trimethyl-pyrrolidin-1-ium-1-carboxamide Openeye Name: 3-[(4-methoxyphenyl)methylsulfanyl]-N,N,1-trimethyl-pyrrolidin-1-ium-1-carboxamide CAS Name: 3-[(4-methoxyphenyl)methylthio]-N,N,1-trimethyl-1-pyrrolidin-1-iumcarboxamide IUPAC Name: 3-[(4-methoxyphenyl)methylsulfanyl]-N,N,1-trimethylpyrrolidin-1-ium-1-carboxamide Traditional Name: N,N,1-trimethyl-3-(p-anisylthio)pyrrolidin-1-ium-1-carboxamide Formula: C16H25N2O2S+ MolecularWeight: 309.4469

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)[N+]1(CCC(C1)SCC2=CC=C(C=C2)OC)C

Isomeric SMILES

CN(C)C(=O)[N+]1(CCC(C1)SCC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C16H25N2O2S/c1-17(2)16(19)18(3)10-9-15(11-18)21-12-13-5-7-14(20-4)8-6-13/h5-8,15H,9-12H2,1-4H3/q+1