[(2R)-2-(2,5-dimethylphenyl)-2-oxidanyl-butyl]azanium

Systemtic Name: [(2R)-2-(2,5-dimethylphenyl)-2-oxidanyl-butyl]azanium Openeye Name: [(2R)-2-(2,5-dimethylphenyl)-2-hydroxy-butyl]ammonium CAS Name: [(2R)-2-(2,5-dimethylphenyl)-2-hydroxybutyl]ammonium IUPAC Name: [(2R)-2-(2,5-dimethylphenyl)-2-hydroxybutyl]azanium Traditional Name: [(2R)-2-(2,5-dimethylphenyl)-2-hydroxy-butyl]ammonium Formula: C12H20NO+ MolecularWeight: 194.2933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO/c1-4-12(14,8-13)11-7-9(2)5-6-10(11)3/h5-7,14H,4,8,13H2,1-3H3/p+1/t12-/m0/s1