(2-chloranyl-6-fluoranyl-phenyl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)acrylic acid (2-chloro-6-fluoro-benzyl) ester Formula: C20H16ClFN2O2 MolecularWeight: 370.804643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=CC(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H16ClFN2O2/c21-18-7-4-8-19(22)17(18)14-26-20(25)10-9-16-11-23-24(13-16)12-15-5-2-1-3-6-15/h1-11,13H,12,14H2/b10-9+