[(2R)-6-methylheptan-2-yl]-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [(2R)-6-methylheptan-2-yl]-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [(1R)-1,5-dimethylhexyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [(2R)-6-methylheptan-2-yl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [(2R)-6-methylheptan-2-yl]-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [(1R)-1,5-dimethylhexyl]-[4-(methylthio)benzyl]ammonium Formula: C16H28NS+ MolecularWeight: 266.46522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)[NH2+]CC1=CC=C(C=C1)SC

Isomeric SMILES

C[C@H](CCCC(C)C)[NH2+]CC1=CC=C(C=C1)SC

InChI

InChI=1S/C16H27NS/c1-13(2)6-5-7-14(3)17-12-15-8-10-16(18-4)11-9-15/h8-11,13-14,17H,5-7,12H2,1-4H3/p+1/t14-/m1/s1