phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium

Systemtic Name: phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Openeye Name: phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium CAS Name: phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium IUPAC Name: phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Traditional Name: phenethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium Formula: C17H28N+ MolecularWeight: 246.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)[NH2+]CCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H27N/c1-14-11-16(13-17(2,3)12-14)18-10-9-15-7-5-4-6-8-15/h4-8,14,16,18H,9-13H2,1-3H3/p+1/t14-,16-/m0/s1