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

Systemtic Name: [3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-[(1-ethylimidazol-2-yl)methyl]-methyl-azanium Openeye Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-[(1-ethylimidazol-2-yl)methyl]-methyl-ammonium CAS Name: [3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-[(1-ethyl-2-imidazolyl)methyl]-methylammonium IUPAC Name: [3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-[(1-ethylimidazol-2-yl)methyl]-methylazanium Traditional Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-[(1-ethylimidazol-2-yl)methyl]-methyl-ammonium Formula: C26H28N5O+ MolecularWeight: 426.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1C[NH+](C)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

Isomeric SMILES

CCN1C=CN=C1C[NH+](C)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

InChI

InChI=1S/C26H27N5O/c1-3-30-14-13-27-25(30)19-29(2)17-22-18-31(16-20-9-5-4-6-10-20)28-26(22)24-15-21-11-7-8-12-23(21)32-24/h4-15,18H,3,16-17,19H2,1-2H3/p+1