[(2S)-3-(2,4-dimethylphenoxy)-2-oxidanyl-propyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [(2S)-3-(2,4-dimethylphenoxy)-2-oxidanyl-propyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [(2S)-3-(2,4-dimethylphenoxy)-2-hydroxy-propyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [(2S)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(2S)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [(2S)-3-(2,4-dimethylphenoxy)-2-hydroxy-propyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C15H26NO3+ MolecularWeight: 268.37184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(C[NH2+]C(C)(C)CO)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC[C@H](C[NH2+]C(C)(C)CO)O)C

InChI

InChI=1S/C15H25NO3/c1-11-5-6-14(12(2)7-11)19-9-13(18)8-16-15(3,4)10-17/h5-7,13,16-18H,8-10H2,1-4H3/p+1/t13-/m0/s1