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

Systemtic Name: [3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-[(3S)-oxolan-3-yl]azanium Openeye Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-[(3S)-tetrahydrofuran-3-yl]ammonium CAS Name: [3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-methyl-[(3S)-3-oxolanyl]ammonium IUPAC Name: [3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-methyl-[(3S)-oxolan-3-yl]azanium Traditional Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-[(3S)-tetrahydrofuran-3-yl]ammonium Formula: C24H26N3O2+ MolecularWeight: 388.48214

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)C5CCOC5

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)[C@H]5CCOC5

InChI

InChI=1S/C24H25N3O2/c1-26(21-11-12-28-17-21)15-20-16-27(14-18-7-3-2-4-8-18)25-24(20)23-13-19-9-5-6-10-22(19)29-23/h2-10,13,16,21H,11-12,14-15,17H2,1H3/p+1/t21-/m0/s1