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

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-[1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazol-4-yl]prop-2-enoate Openeye Name: 2-methoxyethyl (E)-2-cyano-3-[1-(4-fluorophenyl)-3-(p-tolyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[1-(4-fluorophenyl)-3-(4-methylphenyl)-4-pyrazolyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-2-cyano-3-[1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[1-(4-fluorophenyl)-3-(p-tolyl)pyrazol-4-yl]acrylic acid 2-methoxyethyl ester Formula: C23H20FN3O3 MolecularWeight: 405.421603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)OCCOC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)OCCOC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H20FN3O3/c1-16-3-5-17(6-4-16)22-19(13-18(14-25)23(28)30-12-11-29-2)15-27(26-22)21-9-7-20(24)8-10-21/h3-10,13,15H,11-12H2,1-2H3/b18-13+