[(1R,2R)-1-(4-methylphenyl)-2-(2-methylpropoxy)propyl]azanium

Systemtic Name: [(1R,2R)-1-(4-methylphenyl)-2-(2-methylpropoxy)propyl]azanium Openeye Name: [(1R,2R)-2-isobutoxy-1-(p-tolyl)propyl]ammonium CAS Name: [(1R,2R)-1-(4-methylphenyl)-2-(2-methylpropoxy)propyl]ammonium IUPAC Name: [(1R,2R)-1-(4-methylphenyl)-2-(2-methylpropoxy)propyl]azanium Traditional Name: [(1R,2R)-2-isobutoxy-1-(p-tolyl)propyl]ammonium Formula: C14H24NO+ MolecularWeight: 222.34646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C)OCC(C)C)[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@@H](C)OCC(C)C)[NH3+]

InChI

InChI=1S/C14H23NO/c1-10(2)9-16-12(4)14(15)13-7-5-11(3)6-8-13/h5-8,10,12,14H,9,15H2,1-4H3/p+1/t12-,14+/m1/s1