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

Systemtic Name: [(2S)-2-(2,5-dimethylphenyl)-2-oxidanyl-butyl]-ethyl-azanium Openeye Name: [(2S)-2-(2,5-dimethylphenyl)-2-hydroxy-butyl]-ethyl-ammonium CAS Name: [(2S)-2-(2,5-dimethylphenyl)-2-hydroxybutyl]-ethylammonium IUPAC Name: [(2S)-2-(2,5-dimethylphenyl)-2-hydroxybutyl]-ethylazanium Traditional Name: [(2S)-2-(2,5-dimethylphenyl)-2-hydroxy-butyl]-ethyl-ammonium Formula: C14H24NO+ MolecularWeight: 222.34646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH2+]CC)(C1=C(C=CC(=C1)C)C)O

Isomeric SMILES

CC[C@@](C[NH2+]CC)(C1=C(C=CC(=C1)C)C)O

InChI

InChI=1S/C14H23NO/c1-5-14(16,10-15-6-2)13-9-11(3)7-8-12(13)4/h7-9,15-16H,5-6,10H2,1-4H3/p+1/t14-/m1/s1