2-cyanoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: 2-cyanoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: 2-cyanoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: 2-cyanoethyl-[(1,3-diphenyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: 2-cyanoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methylazanium Traditional Name: 2-cyanoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C20H21N4+ MolecularWeight: 317.40754

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC#N)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](CCC#N)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4/c1-23(14-8-13-21)15-18-16-24(19-11-6-3-7-12-19)22-20(18)17-9-4-2-5-10-17/h2-7,9-12,16H,8,14-15H2,1H3/p+1