diethyl-[2-(3-oxidanyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: diethyl-[2-(3-oxidanyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)ethyl]azanium Openeye Name: diethyl-[2-(3-hydroxy-5-oxo-1,2-diphenyl-pyrazol-4-yl)ethyl]ammonium CAS Name: diethyl-[2-(3-hydroxy-5-oxo-1,2-diphenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: diethyl-[2-(3-hydroxy-5-oxo-1,2-diphenylpyrazol-4-yl)ethyl]azanium Traditional Name: diethyl-[2-(3-hydroxy-5-keto-1,2-diphenyl-3-pyrazolin-4-yl)ethyl]ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC[NH+](CC)CCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C21H25N3O2/c1-3-22(4-2)16-15-19-20(25)23(17-11-7-5-8-12-17)24(21(19)26)18-13-9-6-10-14-18/h5-14,25H,3-4,15-16H2,1-2H3/p+1