[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino] 2-fluoranylbenzoate

Systemtic Name: [2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino] 2-fluoranylbenzoate Openeye Name: [[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino] ester IUPAC Name: [[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino] ester Formula: C14H13FN4O5 MolecularWeight: 336.275223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NOC(=O)C2=CC=CC=C2F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NOC(=O)C2=CC=CC=C2F)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13FN4O5/c1-8-13(19(22)23)9(2)18(16-8)7-12(20)17-24-14(21)10-5-3-4-6-11(10)15/h3-6H,7H2,1-2H3,(H,17,20)