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

Systemtic Name: [4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]methylazanium Openeye Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]methylammonium CAS Name: [4-(4-chloro-3,5-dimethyl-1-pyrazolyl)phenyl]methylammonium IUPAC Name: [4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]methylazanium Traditional Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)benzyl]ammonium Formula: C12H15ClN3+ MolecularWeight: 236.7206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3/c1-8-12(13)9(2)16(15-8)11-5-3-10(7-14)4-6-11/h3-6H,7,14H2,1-2H3/p+1