1-[2-(3-methylphenoxy)ethyl]-2-phenyl-pyrazol-1-ium

Systemtic Name: 1-[2-(3-methylphenoxy)ethyl]-2-phenyl-pyrazol-1-ium Openeye Name: 1-[2-(3-methylphenoxy)ethyl]-2-phenyl-pyrazol-1-ium CAS Name: 1-[2-(3-methylphenoxy)ethyl]-2-phenylpyrazol-1-ium IUPAC Name: 1-[2-(3-methylphenoxy)ethyl]-2-phenylpyrazol-1-ium Traditional Name: 1-[2-(3-methylphenoxy)ethyl]-2-phenyl-pyrazol-1-ium Formula: C18H19N2O+ MolecularWeight: 279.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC[N+]2=CC=CN2C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCC[N+]2=CC=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H19N2O/c1-16-7-5-10-18(15-16)21-14-13-19-11-6-12-20(19)17-8-3-2-4-9-17/h2-12,15H,13-14H2,1H3/q+1