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

Systemtic Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]-methyl-azanium Openeye Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-2,3-dihydrobenzofuran-2-yl]methyl]-methyl-ammonium CAS Name: [5-(2-benzofuranyl)-1H-pyrazol-4-yl]methyl-[[(2R)-2,3-dihydrobenzofuran-2-yl]methyl]-methylammonium IUPAC Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]-methylazanium Traditional Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-coumaran-2-yl]methyl]-methyl-ammonium Formula: C22H22N3O2+ MolecularWeight: 360.42898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CC2=CC=CC=C2O1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C[NH+](C[C@H]1CC2=CC=CC=C2O1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C22H21N3O2/c1-25(14-18-10-15-6-2-4-8-19(15)26-18)13-17-12-23-24-22(17)21-11-16-7-3-5-9-20(16)27-21/h2-9,11-12,18H,10,13-14H2,1H3,(H,23,24)/p+1/t18-/m1/s1