2-(1-tert-butyl-4-phenyl-5-propan-2-yl-pyrazol-1-ium-1-yl)-4,4-dimethyl-5H-1,3-oxazole

Systemtic Name: 2-(1-tert-butyl-4-phenyl-5-propan-2-yl-pyrazol-1-ium-1-yl)-4,4-dimethyl-5H-1,3-oxazole Openeye Name: 2-(1-tert-butyl-5-isopropyl-4-phenyl-pyrazol-1-ium-1-yl)-4,4-dimethyl-5H-oxazole CAS Name: 2-(1-tert-butyl-4-phenyl-5-propan-2-yl-1-pyrazol-1-iumyl)-4,4-dimethyl-5H-oxazole IUPAC Name: 2-(1-tert-butyl-4-phenyl-5-propan-2-ylpyrazol-1-ium-1-yl)-4,4-dimethyl-5H-1,3-oxazole Traditional Name: 2-(1-tert-butyl-5-isopropyl-4-phenyl-pyrazol-1-ium-1-yl)-4,4-dimethyl-2-oxazoline Formula: C21H30N3O+ MolecularWeight: 340.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=N[N+]1(C2=NC(CO2)(C)C)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C=N[N+]1(C2=NC(CO2)(C)C)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H30N3O/c1-15(2)18-17(16-11-9-8-10-12-16)13-22-24(18,20(3,4)5)19-23-21(6,7)14-25-19/h8-13,15H,14H2,1-7H3/q+1