[(1S,2S,4S)-4-ethyl-2-[4-(2-methylbutan-2-yl)phenoxy]cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-4-ethyl-2-[4-(2-methylbutan-2-yl)phenoxy]cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-2-[4-(1,1-dimethylpropyl)phenoxy]-4-ethyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-4-ethyl-2-[4-(2-methylbutan-2-yl)phenoxy]cyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-4-ethyl-2-[4-(2-methylbutan-2-yl)phenoxy]cyclohexyl]azanium Traditional Name: [(1S,2S,4S)-2-(4-tert-amylphenoxy)-4-ethyl-cyclohexyl]ammonium Formula: C19H32NO+ MolecularWeight: 290.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(C1)OC2=CC=C(C=C2)C(C)(C)CC)[NH3+]

Isomeric SMILES

CC[C@H]1CC[C@@H]([C@H](C1)OC2=CC=C(C=C2)C(C)(C)CC)[NH3+]

InChI

InChI=1S/C19H31NO/c1-5-14-7-12-17(20)18(13-14)21-16-10-8-15(9-11-16)19(3,4)6-2/h8-11,14,17-18H,5-7,12-13,20H2,1-4H3/p+1/t14-,17-,18-/m0/s1