methyl 2-[4-(N-cyclopropyl-C-methyl-carbonimidoyl)-1-(4-fluorophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-(N-cyclopropyl-C-methyl-carbonimidoyl)-1-(4-fluorophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[4-(N-cyclopropyl-C-methyl-carbonimidoyl)-1-(4-fluorophenyl)-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[4-(1-cyclopropyliminoethyl)-1-(4-fluorophenyl)-5-oxo-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(N-cyclopropyl-C-methylcarbonimidoyl)-1-(4-fluorophenyl)-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[4-(N-cyclopropyl-C-methyl-carbonimidoyl)-1-(4-fluorophenyl)-5-keto-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1CC1)C2C(=NN(C2=O)C3=CC=C(C=C3)F)CC(=O)OC

Isomeric SMILES

CC(=NC1CC1)C2C(=NN(C2=O)C3=CC=C(C=C3)F)CC(=O)OC

InChI

InChI=1S/C17H18FN3O3/c1-10(19-12-5-6-12)16-14(9-15(22)24-2)20-21(17(16)23)13-7-3-11(18)4-8-13/h3-4,7-8,12,16H,5-6,9H2,1-2H3