[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]methylazanium

Systemtic Name: [1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]methylazanium Openeye Name: [1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]methylammonium CAS Name: [1-(4-bromophenyl)-3,5-dimethyl-4-pyrazolyl]methylammonium IUPAC Name: [1-(4-bromophenyl)-3,5-dimethylpyrazol-4-yl]methylazanium Traditional Name: [1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]methylammonium Formula: C12H15BrN3+ MolecularWeight: 281.1716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)Br)C)C[NH3+]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)Br)C)C[NH3+]

InChI

InChI=1S/C12H14BrN3/c1-8-12(7-14)9(2)16(15-8)11-5-3-10(13)4-6-11/h3-6H,7,14H2,1-2H3/p+1