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

Systemtic Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: 3-isopropoxypropyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: [3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: 3-isopropoxypropyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC[NH2+]CC1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)OCCC[NH2+]CC1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c1-18(2)28-15-7-14-24-16-20-17-26(21-8-5-4-6-9-21)25-23(20)19-10-12-22(27-3)13-11-19/h4-6,8-13,17-18,24H,7,14-16H2,1-3H3/p+1