3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propylazanium

Systemtic Name: 3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propylazanium Openeye Name: 3-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]propylammonium CAS Name: 3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propylammonium IUPAC Name: 3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propylazanium Traditional Name: 3-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)propylammonium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CCC[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CCC[NH3+]

InChI

InChI=1S/C14H19N3O/c1-10(2)11-5-7-12(8-6-11)14-16-13(18-17-14)4-3-9-15/h5-8,10H,3-4,9,15H2,1-2H3/p+1