2-cyanoethyl-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: 2-cyanoethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: 2-cyanoethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: 2-cyanoethyl-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: 2-cyanoethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: 2-cyanoethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C13H15N4+ MolecularWeight: 227.285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C[NH2+]CCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C[NH2+]CCC#N

InChI

InChI=1S/C13H14N4/c14-7-4-8-15-9-12-10-16-17(11-12)13-5-2-1-3-6-13/h1-3,5-6,10-11,15H,4,8-9H2/p+1