[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-[(2S)-4-phenylbutan-2-yl]azanium

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-[(2S)-4-phenylbutan-2-yl]azanium Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-[(1S)-1-methyl-3-phenyl-propyl]ammonium CAS Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-[(2S)-4-phenylbutan-2-yl]ammonium IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-[(2S)-4-phenylbutan-2-yl]azanium Traditional Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-[(1S)-1-methyl-3-phenyl-propyl]ammonium Formula: C20H34N+ MolecularWeight: 288.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]C(C)CCC2=CC=CC=C2)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)[NH2+][C@@H](C)CCC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C20H33N/c1-15(2)19-13-10-16(3)14-20(19)21-17(4)11-12-18-8-6-5-7-9-18/h5-9,15-17,19-21H,10-14H2,1-4H3/p+1/t16-,17-,19+,20-/m0/s1