furan-2-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(3-pyridylmethyl)ammonium CAS Name: 2-furanylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 2-furfuryl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-(3-pyridylmethyl)ammonium Formula: C21H21N4O+ MolecularWeight: 345.41764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C21H20N4O/c1-2-7-18(8-3-1)21-19(13-23-24-21)15-25(16-20-9-5-11-26-20)14-17-6-4-10-22-12-17/h1-13H,14-16H2,(H,23,24)/p+1