1-ethyl-4-iodanyl-3,5-dimethyl-2-phenyl-pyrazol-1-ium

Systemtic Name: 1-ethyl-4-iodanyl-3,5-dimethyl-2-phenyl-pyrazol-1-ium Openeye Name: 1-ethyl-4-iodo-3,5-dimethyl-2-phenyl-pyrazol-1-ium CAS Name: 1-ethyl-4-iodo-3,5-dimethyl-2-phenylpyrazol-1-ium IUPAC Name: 1-ethyl-4-iodo-3,5-dimethyl-2-phenylpyrazol-1-ium Traditional Name: 1-ethyl-4-iodo-3,5-dimethyl-2-phenyl-pyrazol-1-ium Formula: C13H16IN2+ MolecularWeight: 327.18401

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(=C(N1C2=CC=CC=C2)C)I)C

Isomeric SMILES

CC[N+]1=C(C(=C(N1C2=CC=CC=C2)C)I)C

InChI

InChI=1S/C13H16IN2/c1-4-15-10(2)13(14)11(3)16(15)12-8-6-5-7-9-12/h5-9H,4H2,1-3H3/q+1