ethyl 3-[(4-fluoranyl-2-nitro-phenyl)amino]-1-propan-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-[(4-fluoranyl-2-nitro-phenyl)amino]-1-propan-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 3-(4-fluoro-2-nitro-anilino)-1-isopropyl-pyrazole-4-carboxylate CAS Name: 3-(4-fluoro-2-nitroanilino)-1-propan-2-yl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluoro-2-nitroanilino)-1-propan-2-ylpyrazole-4-carboxylate Traditional Name: 3-(4-fluoro-2-nitro-anilino)-1-isopropyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H17FN4O4 MolecularWeight: 336.318283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1NC2=C(C=C(C=C2)F)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCOC(=O)C1=CN(N=C1NC2=C(C=C(C=C2)F)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C15H17FN4O4/c1-4-24-15(21)11-8-19(9(2)3)18-14(11)17-12-6-5-10(16)7-13(12)20(22)23/h5-9H,4H2,1-3H3,(H,17,18)