2-(4-heptylsulfanyl-2,5-dimethoxy-phenyl)ethyl-methyl-azanium

Systemtic Name: 2-(4-heptylsulfanyl-2,5-dimethoxy-phenyl)ethyl-methyl-azanium Openeye Name: 2-(4-heptylsulfanyl-2,5-dimethoxy-phenyl)ethyl-methyl-ammonium CAS Name: 2-[4-(heptylthio)-2,5-dimethoxyphenyl]ethyl-methylammonium IUPAC Name: 2-(4-heptylsulfanyl-2,5-dimethoxyphenyl)ethyl-methylazanium Traditional Name: 2-[4-(heptylthio)-2,5-dimethoxy-phenyl]ethyl-methyl-ammonium Formula: C18H32NO2S+ MolecularWeight: 326.51718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=C(C=C(C(=C1)OC)CC[NH2+]C)OC

Isomeric SMILES

CCCCCCCSC1=C(C=C(C(=C1)OC)CC[NH2+]C)OC

InChI

InChI=1S/C18H31NO2S/c1-5-6-7-8-9-12-22-18-14-16(20-3)15(10-11-19-2)13-17(18)21-4/h13-14,19H,5-12H2,1-4H3/p+1