diethyl-[(2S)-3-[2-methoxy-4-[(2-methylsulfanylethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2S)-3-[2-methoxy-4-[(2-methylsulfanylethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(2-methylsulfanylethylammonio)methyl]phenoxy]propyl]ammonium CAS Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[2-(methylthio)ethylammonio]methyl]phenoxy]propyl]ammonium IUPAC Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(2-methylsulfanylethylazaniumyl)methyl]phenoxy]propyl]azanium Traditional Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[2-(methylthio)ethylammonio]methyl]phenoxy]propyl]ammonium Formula: C18H34N2O3S+2 MolecularWeight: 358.53916

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC1=C(C=C(C=C1)C[NH2+]CCSC)OC)O

Isomeric SMILES

CC[NH+](CC)C[C@@H](COC1=C(C=C(C=C1)C[NH2+]CCSC)OC)O

InChI

InChI=1S/C18H32N2O3S/c1-5-20(6-2)13-16(21)14-23-17-8-7-15(11-18(17)22-3)12-19-9-10-24-4/h7-8,11,16,19,21H,5-6,9-10,12-14H2,1-4H3/p+2/t16-/m0/s1