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

Systemtic Name: ethyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: ethyl-[2-(isopropylamino)-2-oxo-ethyl]-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: ethyl-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: ethyl-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: ethyl-[2-(isopropylamino)-2-keto-ethyl]-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O2/c1-5-27(17-23(29)25-18(2)3)15-20-16-28(21-9-7-6-8-10-21)26-24(20)19-11-13-22(30-4)14-12-19/h6-14,16,18H,5,15,17H2,1-4H3,(H,25,29)/p+1