prop-2-enyl (E)-3-[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate

Systemtic Name: prop-2-enyl (E)-3-[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: allyl (E)-3-[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-4-pyrazolyl]-2-cyano-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-3-[5-chloro-1-[(4-fluorophenyl)methyl]-3-methylpyrazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-chloro-1-(4-fluorobenzyl)-3-methyl-pyrazol-4-yl]-2-cyano-acrylic acid allyl ester Formula: C18H15ClFN3O2 MolecularWeight: 359.782003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C(=O)OCC=C)Cl)CC2=CC=C(C=C2)F

Isomeric SMILES

CC1=NN(C(=C1/C=C(\C#N)/C(=O)OCC=C)Cl)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H15ClFN3O2/c1-3-8-25-18(24)14(10-21)9-16-12(2)22-23(17(16)19)11-13-4-6-15(20)7-5-13/h3-7,9H,1,8,11H2,2H3/b14-9+