2-hydroxyethyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-propan-2-yl-azanium

Systemtic Name: 2-hydroxyethyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-propan-2-yl-azanium Openeye Name: 2-hydroxyethyl-isopropyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: 2-hydroxyethyl-[[3-(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-propan-2-ylammonium IUPAC Name: 2-hydroxyethyl-[[3-(3-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-propan-2-ylazanium Traditional Name: 2-hydroxyethyl-isopropyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCO)CC1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+](CCO)CC1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-17(2)24(12-13-26)15-19-16-25(20-9-5-4-6-10-20)23-22(19)18-8-7-11-21(14-18)27-3/h4-11,14,16-17,26H,12-13,15H2,1-3H3/p+1