[(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: [(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: [(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(1R)-1-methyl-3-phenyl-propyl]ammonium CAS Name: [(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: [(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: [(1S,2S,3R)-2,3-dimethylcyclohexyl]-[(1R)-1-methyl-3-phenyl-propyl]ammonium Formula: C18H30N+ MolecularWeight: 260.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]C(C)CCC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCC[C@@H]([C@H]1C)[NH2+][C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C18H29N/c1-14-8-7-11-18(16(14)3)19-15(2)12-13-17-9-5-4-6-10-17/h4-6,9-10,14-16,18-19H,7-8,11-13H2,1-3H3/p+1/t14-,15-,16+,18+/m1/s1