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

Systemtic Name: ethyl-(2-hydroxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]azanium Openeye Name: ethyl-(2-hydroxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]ammonium CAS Name: ethyl-(2-hydroxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: ethyl-(2-hydroxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]azanium Traditional Name: ethyl-(2-hydroxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC1=CN(N=C1C2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CC[NH+](CCO)CC1=CN(N=C1C2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O2/c1-3-24(13-14-25)16-18-15-23(2)22-21(18)17-9-11-20(12-10-17)26-19-7-5-4-6-8-19/h4-12,15,25H,3,13-14,16H2,1-2H3/p+1