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

Systemtic Name: [3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)azanium Openeye Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)ammonium CAS Name: [3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-ethyl-(2-hydroxyethyl)ammonium IUPAC Name: [3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)azanium Traditional Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)ammonium Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O2/c1-2-25(12-13-27)16-20-17-26(15-18-8-4-3-5-9-18)24-23(20)22-14-19-10-6-7-11-21(19)28-22/h3-11,14,17,27H,2,12-13,15-16H2,1H3/p+1