3-deuterio-1,2,3-trimethyl-5-phenyl-4H-pyrazol-1-ium

Systemtic Name: 3-deuterio-1,2,3-trimethyl-5-phenyl-4H-pyrazol-1-ium Openeye Name: 3-deuterio-1,2,3-trimethyl-5-phenyl-4H-pyrazol-1-ium CAS Name: 3-deuterio-1,2,3-trimethyl-5-phenyl-4H-pyrazol-1-ium IUPAC Name: 3-deuterio-1,2,3-trimethyl-5-phenyl-4H-pyrazol-1-ium Traditional Name: 3-deuterio-1,2,3-trimethyl-5-phenyl-2-pyrazolin-1-ium Formula: C12H17N2+ MolecularWeight: 190.282942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=[N+](N1C)C)C2=CC=CC=C2

Isomeric SMILES

[2H]C1(CC(=[N+](N1C)C)C2=CC=CC=C2)C

InChI

InChI=1S/C12H17N2/c1-10-9-12(14(3)13(10)2)11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3/q+1/i10D