(2-azanyl-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-4-pyrazolecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C19H16FN3O4 MolecularWeight: 369.346443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FN3O4/c1-26-15-4-2-3-12(9-15)18-16(19(25)27-11-17(21)24)10-23(22-18)14-7-5-13(20)6-8-14/h2-10H,11H2,1H3,(H2,21,24)