2-(3-methoxyphenyl)ethyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: 2-(3-methoxyphenyl)ethyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: 2-(3-methoxyphenyl)ethyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: 2-(3-methoxyphenyl)ethyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: 2-(3-methoxyphenyl)ethyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: 2-(3-methoxyphenyl)ethyl-[4-(methylthio)benzyl]ammonium Formula: C17H22NOS+ MolecularWeight: 288.42768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC[NH2+]CC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC=CC(=C1)CC[NH2+]CC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H21NOS/c1-19-16-5-3-4-14(12-16)10-11-18-13-15-6-8-17(20-2)9-7-15/h3-9,12,18H,10-11,13H2,1-2H3/p+1