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

Systemtic Name: methyl-[2-(oxan-4-yl)ethyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: methyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-(2-tetrahydropyran-4-ylethyl)ammonium CAS Name: methyl-[2-(4-oxanyl)ethyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: methyl-[2-(oxan-4-yl)ethyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: methyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-(2-tetrahydropyran-4-ylethyl)ammonium Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1CCOCC1)CC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](CCC1CCOCC1)CC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C17H23N3O2/c1-20(10-7-14-8-11-21-12-9-14)13-16-18-17(19-22-16)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3/p+1