2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: homoveratryl-methyl-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=NC(=NO2)C3=CC=CC=N3

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=NC(=NO2)C3=CC=CC=N3

InChI

InChI=1S/C19H22N4O3/c1-23(11-9-14-7-8-16(24-2)17(12-14)25-3)13-18-21-19(22-26-18)15-6-4-5-10-20-15/h4-8,10,12H,9,11,13H2,1-3H3/p+1