1,2-dimethyl-1-(3-methylphenyl)-5-phenyl-4-propoxy-3H-pyrazol-1-ium

Systemtic Name: 1,2-dimethyl-1-(3-methylphenyl)-5-phenyl-4-propoxy-3H-pyrazol-1-ium Openeye Name: 1,2-dimethyl-1-(m-tolyl)-5-phenyl-4-propoxy-3H-pyrazol-1-ium CAS Name: 1,2-dimethyl-1-(3-methylphenyl)-5-phenyl-4-propoxy-3H-pyrazol-1-ium IUPAC Name: 1,2-dimethyl-1-(3-methylphenyl)-5-phenyl-4-propoxy-3H-pyrazol-1-ium Traditional Name: 1,2-dimethyl-1-(m-tolyl)-5-phenyl-4-propoxy-3-pyrazolin-1-ium Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C([N+](N(C1)C)(C)C2=CC=CC(=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=C([N+](N(C1)C)(C)C2=CC=CC(=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H27N2O/c1-5-14-24-20-16-22(3)23(4,19-13-9-10-17(2)15-19)21(20)18-11-7-6-8-12-18/h6-13,15H,5,14,16H2,1-4H3/q+1