[(1R)-1-(3-methoxyphenyl)-2-(3-methylsulfanylpropylazaniumyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methylsulfanylpropylazaniumyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methylsulfanylpropylammonio)ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(3-methoxyphenyl)-2-[3-(methylthio)propylammonio]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methylsulfanylpropylazaniumyl)ethyl]-dimethylazanium Traditional Name: [(1R)-1-(3-methoxyphenyl)-2-[3-(methylthio)propylammonio]ethyl]-dimethyl-ammonium Formula: C15H28N2OS+2 MolecularWeight: 284.46062

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(C[NH2+]CCCSC)C1=CC(=CC=C1)OC

Isomeric SMILES

C[NH+](C)[C@@H](C[NH2+]CCCSC)C1=CC(=CC=C1)OC

InChI

InChI=1S/C15H26N2OS/c1-17(2)15(12-16-9-6-10-19-4)13-7-5-8-14(11-13)18-3/h5,7-8,11,15-16H,6,9-10,12H2,1-4H3/p+2/t15-/m0/s1