(2R)-1-phenyl-2-[5-[(1-propan-2-ylpyridin-1-ium-4-yl)methyl]-1,3,4-oxadiazol-2-yl]propan-2-amine

Systemtic Name: (2R)-1-phenyl-2-[5-[(1-propan-2-ylpyridin-1-ium-4-yl)methyl]-1,3,4-oxadiazol-2-yl]propan-2-amine Openeye Name: (2R)-2-[5-[(1-isopropylpyridin-1-ium-4-yl)methyl]-1,3,4-oxadiazol-2-yl]-1-phenyl-propan-2-amine CAS Name: (2R)-1-phenyl-2-[5-[(1-propan-2-yl-4-pyridin-1-iumyl)methyl]-1,3,4-oxadiazol-2-yl]-2-propanamine IUPAC Name: (2R)-1-phenyl-2-[5-[(1-propan-2-ylpyridin-1-ium-4-yl)methyl]-1,3,4-oxadiazol-2-yl]propan-2-amine Traditional Name: [(1R)-1-[5-[(1-isopropylpyridin-1-ium-4-yl)methyl]-1,3,4-oxadiazol-2-yl]-1-methyl-2-phenyl-ethyl]amine Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=CC=C(C=C1)CC2=NN=C(O2)C(C)(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)[N+]1=CC=C(C=C1)CC2=NN=C(O2)[C@@](C)(CC3=CC=CC=C3)N

InChI

InChI=1S/C20H25N4O/c1-15(2)24-11-9-16(10-12-24)13-18-22-23-19(25-18)20(3,21)14-17-7-5-4-6-8-17/h4-12,15H,13-14,21H2,1-3H3/q+1/t20-/m1/s1