2-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]ethylazanium

Systemtic Name: 2-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]ethylazanium Openeye Name: 2-[(4-isobutoxyphenyl)methylsulfanyl]ethylammonium CAS Name: 2-[[4-(2-methylpropoxy)phenyl]methylthio]ethylammonium IUPAC Name: 2-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]ethylazanium Traditional Name: 2-[(4-isobutoxybenzyl)thio]ethylammonium Formula: C13H22NOS+ MolecularWeight: 240.38488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CSCC[NH3+]

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CSCC[NH3+]

InChI

InChI=1S/C13H21NOS/c1-11(2)9-15-13-5-3-12(4-6-13)10-16-8-7-14/h3-6,11H,7-10,14H2,1-2H3/p+1