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

Systemtic Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [2-(isopropylamino)-2-oxo-ethyl]-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium CAS Name: [3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-(isopropylamino)-2-keto-ethyl]-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2/c1-17(2)24-22(28)16-26(3)14-19-15-27(20-8-6-5-7-9-20)25-23(19)18-10-12-21(29-4)13-11-18/h5-13,15,17H,14,16H2,1-4H3,(H,24,28)/p+1