[(S)-(2,4-dimethylphenyl)-[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: [(S)-(2,4-dimethylphenyl)-[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: [(S)-(2,4-dimethylphenyl)-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: [(S)-(2,4-dimethylphenyl)-[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: [(S)-(2,4-dimethylphenyl)-[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: [(S)-(2,4-dimethylphenyl)-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C13H20NO+ MolecularWeight: 206.304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C2CCCO2)[NH3+])C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@@H]([C@H]2CCCO2)[NH3+])C

InChI

InChI=1S/C13H19NO/c1-9-5-6-11(10(2)8-9)13(14)12-4-3-7-15-12/h5-6,8,12-13H,3-4,7,14H2,1-2H3/p+1/t12-,13+/m1/s1