ethyl-[2-[2-(4-nitrophenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: ethyl-[2-[2-(4-nitrophenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: ethyl-[2-[5-isopropyl-2-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-[2-(4-nitrophenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]ammonium IUPAC Name: ethyl-[2-[2-(4-nitrophenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]azanium Traditional Name: ethyl-[2-[3-isopropyl-5-keto-1-(4-nitrophenyl)-3-pyrazolin-4-yl]-2-keto-ethyl]ammonium Formula: C16H21N4O4+ MolecularWeight: 333.36234

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC[NH2+]CC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C16H20N4O4/c1-4-17-9-13(21)14-15(10(2)3)18-19(16(14)22)11-5-7-12(8-6-11)20(23)24/h5-8,10,17-18H,4,9H2,1-3H3/p+1