[(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium

Systemtic Name: [(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium Openeye Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium CAS Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)ammonium IUPAC Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)azanium Traditional Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium Formula: C15H26NO4+ MolecularWeight: 284.37124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(C[NH+](CCO)CCO)O)C

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO4/c1-12-3-4-15(9-13(12)2)20-11-14(19)10-16(5-7-17)6-8-18/h3-4,9,14,17-19H,5-8,10-11H2,1-2H3/p+1/t14-/m0/s1