(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-ethyl-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC2=NC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC2=NC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O4/c1-5-25(14-16-7-12-19(28-6-2)20(13-16)27-4)15-21-23-22(24-29-21)17-8-10-18(26-3)11-9-17/h7-13H,5-6,14-15H2,1-4H3/p+1