(3,5-dimethyl-4-oxidanyl-phenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl-[(1S)-2-methoxy-1-methyl-ethyl]ammonium CAS Name: (4-hydroxy-3,5-dimethylphenyl)methyl-[(2S)-1-methoxypropan-2-yl]ammonium IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Traditional Name: (4-hydroxy-3,5-dimethyl-benzyl)-[(1S)-2-methoxy-1-methyl-ethyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]C(C)COC

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+][C@@H](C)COC

InChI

InChI=1S/C13H21NO2/c1-9-5-12(6-10(2)13(9)15)7-14-11(3)8-16-4/h5-6,11,14-15H,7-8H2,1-4H3/p+1/t11-/m0/s1