[(1R,2S,3S)-1-(2,5-dimethylthiophen-3-yl)-3-methyl-2-phenyl-pentyl]azanium

Systemtic Name: [(1R,2S,3S)-1-(2,5-dimethylthiophen-3-yl)-3-methyl-2-phenyl-pentyl]azanium Openeye Name: [(1R,2S,3S)-1-(2,5-dimethyl-3-thienyl)-3-methyl-2-phenyl-pentyl]ammonium CAS Name: [(1R,2S,3S)-1-(2,5-dimethyl-3-thiophenyl)-3-methyl-2-phenylpentyl]ammonium IUPAC Name: [(1R,2S,3S)-1-(2,5-dimethylthiophen-3-yl)-3-methyl-2-phenylpentyl]azanium Traditional Name: [(1R,2S,3S)-1-(2,5-dimethyl-3-thienyl)-3-methyl-2-phenyl-pentyl]ammonium Formula: C18H26NS+ MolecularWeight: 288.47074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(C2=C(SC(=C2)C)C)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC=CC=C1)[C@H](C2=C(SC(=C2)C)C)[NH3+]

InChI

InChI=1S/C18H25NS/c1-5-12(2)17(15-9-7-6-8-10-15)18(19)16-11-13(3)20-14(16)4/h6-12,17-18H,5,19H2,1-4H3/p+1/t12-,17-,18-/m0/s1