[(2S)-2-ethylhexyl]-[(1R)-1-(4-methylsulfanylphenyl)ethyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(1R)-1-(4-methylsulfanylphenyl)ethyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(1R)-1-(4-methylsulfanylphenyl)ethyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(1R)-1-[4-(methylthio)phenyl]ethyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(1R)-1-(4-methylsulfanylphenyl)ethyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(1R)-1-[4-(methylthio)phenyl]ethyl]ammonium Formula: C17H30NS+ MolecularWeight: 280.4918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]C(C)C1=CC=C(C=C1)SC

Isomeric SMILES

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

InChI

InChI=1S/C17H29NS/c1-5-7-8-15(6-2)13-18-14(3)16-9-11-17(19-4)12-10-16/h9-12,14-15,18H,5-8,13H2,1-4H3/p+1/t14-,15+/m1/s1