[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C24H24ClN4+ MolecularWeight: 403.92716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH+](CC2=CC=NC=C2)CC3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CC2=CC=NC=C2)CC3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H23ClN4/c25-23-8-6-21(7-9-23)24-22(16-27-28-24)18-29(17-20-10-13-26-14-11-20)15-12-19-4-2-1-3-5-19/h1-11,13-14,16H,12,15,17-18H2,(H,27,28)/p+1