[(1R,2S)-4-methyl-1-(4-methylphenyl)-1-oxidanyl-pentan-2-yl]azanium

Systemtic Name: [(1R,2S)-4-methyl-1-(4-methylphenyl)-1-oxidanyl-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(R)-hydroxy(p-tolyl)methyl]-3-methyl-butyl]ammonium CAS Name: [(1R,2S)-1-hydroxy-4-methyl-1-(4-methylphenyl)pentan-2-yl]ammonium IUPAC Name: [(1R,2S)-1-hydroxy-4-methyl-1-(4-methylphenyl)pentan-2-yl]azanium Traditional Name: [(1S)-1-[(R)-hydroxy(p-tolyl)methyl]-3-methyl-butyl]ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO/c1-9(2)8-12(14)13(15)11-6-4-10(3)5-7-11/h4-7,9,12-13,15H,8,14H2,1-3H3/p+1/t12-,13+/m0/s1