(2,4-dimethylphenyl)methyl-[(2R)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: (2,4-dimethylphenyl)methyl-[(2R)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: (2,4-dimethylphenyl)methyl-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: (2,4-dimethylphenyl)methyl-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: (2,4-dimethylphenyl)methyl-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: (2,4-dimethylbenzyl)-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC(C[NH+](C)CC2=C(C=C(C=C2)C)C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OC[C@@H](C[NH+](C)CC2=C(C=C(C=C2)C)C)O

InChI

InChI=1S/C21H29NO3/c1-5-24-20-8-10-21(11-9-20)25-15-19(23)14-22(4)13-18-7-6-16(2)12-17(18)3/h6-12,19,23H,5,13-15H2,1-4H3/p+1/t19-/m1/s1