methyl 3-azanyl-1-(4-fluorophenyl)carbonyl-pyrazole-4-carboxylate

Systemtic Name: methyl 3-azanyl-1-(4-fluorophenyl)carbonyl-pyrazole-4-carboxylate Openeye Name: methyl 3-amino-1-(4-fluorobenzoyl)pyrazole-4-carboxylate CAS Name: 3-amino-1-[(4-fluorophenyl)-oxomethyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-1-(4-fluorobenzoyl)pyrazole-4-carboxylate Traditional Name: 3-amino-1-(4-fluorobenzoyl)pyrazole-4-carboxylic acid methyl ester Formula: C12H10FN3O3 MolecularWeight: 263.224503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1N)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CN(N=C1N)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H10FN3O3/c1-19-12(18)9-6-16(15-10(9)14)11(17)7-2-4-8(13)5-3-7/h2-6H,1H3,(H2,14,15)