[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]-[3-(2-methylpropoxy)propyl]azanium

Systemtic Name: [(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]-[3-(2-methylpropoxy)propyl]azanium Openeye Name: 3-isobutoxypropyl-[(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]ammonium CAS Name: [(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-[3-(2-methylpropoxy)propyl]ammonium IUPAC Name: [(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-[3-(2-methylpropoxy)propyl]azanium Traditional Name: 3-isobutoxypropyl-[(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]ammonium Formula: C17H36NO+ MolecularWeight: 270.47384

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CCCOCC(C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](C1)[NH2+]CCCOCC(C)C)C(C)C

InChI

InChI=1S/C17H35NO/c1-13(2)12-19-10-6-9-18-17-11-15(5)7-8-16(17)14(3)4/h13-18H,6-12H2,1-5H3/p+1/t15-,16-,17+/m1/s1