(1,3-diphenylpyrazol-4-yl)methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-(3-imidazol-1-ylpropyl)ammonium Formula: C22H24N5+ MolecularWeight: 358.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCCN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCCN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5/c1-3-8-19(9-4-1)22-20(16-23-12-7-14-26-15-13-24-18-26)17-27(25-22)21-10-5-2-6-11-21/h1-6,8-11,13,15,17-18,23H,7,12,14,16H2/p+1