[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]azanium

Systemtic Name: [3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]azanium Openeye Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]ammonium CAS Name: [3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]ammonium IUPAC Name: [3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]azanium Traditional Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]ammonium Formula: C25H26N5O+ MolecularWeight: 412.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+](C)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NN1)C[NH+](C)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

InChI

InChI=1S/C25H25N5O/c1-18-12-22(27-26-18)17-29(2)15-21-16-30(14-19-8-4-3-5-9-19)28-25(21)24-13-20-10-6-7-11-23(20)31-24/h3-13,16H,14-15,17H2,1-2H3,(H,26,27)/p+1