[(S)-(2-iodanylphenyl)-(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(S)-(2-iodanylphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [(S)-(2-iodophenyl)-(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [(S)-(2-iodophenyl)-(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(S)-(2-iodophenyl)-(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [(S)-(2-iodophenyl)-(1-methylpyrazol-4-yl)methyl]ammonium Formula: C11H13IN3+ MolecularWeight: 314.14549

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(C2=CC=CC=C2I)[NH3+]

Isomeric SMILES

CN1C=C(C=N1)[C@@H](C2=CC=CC=C2I)[NH3+]

InChI

InChI=1S/C11H12IN3/c1-15-7-8(6-14-15)11(13)9-4-2-3-5-10(9)12/h2-7,11H,13H2,1H3/p+1/t11-/m0/s1