dimethyl-[[5-[(2S)-2-methylbutyl]-2-oxidanyl-phenyl]methyl]azanium

Systemtic Name: dimethyl-[[5-[(2S)-2-methylbutyl]-2-oxidanyl-phenyl]methyl]azanium Openeye Name: [2-hydroxy-5-[(2S)-2-methylbutyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-hydroxy-5-[(2S)-2-methylbutyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-hydroxy-5-[(2S)-2-methylbutyl]phenyl]methyl-dimethylazanium Traditional Name: [2-hydroxy-5-[(2S)-2-methylbutyl]benzyl]-dimethyl-ammonium Formula: C14H24NO+ MolecularWeight: 222.34646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=CC(=C(C=C1)O)C[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO/c1-5-11(2)8-12-6-7-14(16)13(9-12)10-15(3)4/h6-7,9,11,16H,5,8,10H2,1-4H3/p+1/t11-/m0/s1