2-methoxyethyl 2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: 2-methoxyethyl 2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: 2-methoxyethyl 2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-cyano-3-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]acrylic acid 2-methoxyethyl ester Formula: C22H18FN3O3 MolecularWeight: 391.395023

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3)C#N

Isomeric SMILES

COCCOC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H18FN3O3/c1-28-11-12-29-22(27)17(14-24)13-18-15-26(20-5-3-2-4-6-20)25-21(18)16-7-9-19(23)10-8-16/h2-10,13,15H,11-12H2,1H3