[(1R)-1-(2,5-dimethylthiophen-3-yl)ethyl]-[(2S)-6-methylheptan-2-yl]azanium

Systemtic Name: [(1R)-1-(2,5-dimethylthiophen-3-yl)ethyl]-[(2S)-6-methylheptan-2-yl]azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-[(1R)-1-(2,5-dimethyl-3-thienyl)ethyl]ammonium CAS Name: [(1R)-1-(2,5-dimethyl-3-thiophenyl)ethyl]-[(2S)-6-methylheptan-2-yl]ammonium IUPAC Name: [(1R)-1-(2,5-dimethylthiophen-3-yl)ethyl]-[(2S)-6-methylheptan-2-yl]azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-[(1R)-1-(2,5-dimethyl-3-thienyl)ethyl]ammonium Formula: C16H30NS+ MolecularWeight: 268.4811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)[NH2+]C(C)CCCC(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)[C@@H](C)[NH2+][C@@H](C)CCCC(C)C

InChI

InChI=1S/C16H29NS/c1-11(2)8-7-9-12(3)17-14(5)16-10-13(4)18-15(16)6/h10-12,14,17H,7-9H2,1-6H3/p+1/t12-,14+/m0/s1