furan-2-ylmethyl-[(1-phenylpyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[(1-phenylpyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(1-phenylpyrazol-4-yl)methyl]-(3-pyridylmethyl)ammonium CAS Name: 2-furanylmethyl-[(1-phenyl-4-pyrazolyl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(1-phenylpyrazol-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 2-furfuryl-[(1-phenylpyrazol-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)N2C=C(C=N2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4

InChI

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