2-methoxyethyl-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-propan-2-yl-azanium

Systemtic Name: 2-methoxyethyl-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-propan-2-yl-azanium Openeye Name: isopropyl-(2-methoxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]ammonium CAS Name: 2-methoxyethyl-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]-propan-2-ylammonium IUPAC Name: 2-methoxyethyl-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-propan-2-ylazanium Traditional Name: isopropyl-(2-methoxyethyl)-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]ammonium Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2/c1-18(2)26(14-15-27-4)17-20-16-25(3)24-23(20)19-10-12-22(13-11-19)28-21-8-6-5-7-9-21/h5-13,16,18H,14-15,17H2,1-4H3/p+1