(3-fluoranyl-4-methoxy-phenyl)methyl (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-propan-2-ylphenyl)-2-propenoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-cumenyl-acrylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H20FNO3 MolecularWeight: 353.386803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C21H20FNO3/c1-14(2)17-7-4-15(5-8-17)10-18(12-23)21(24)26-13-16-6-9-20(25-3)19(22)11-16/h4-11,14H,13H2,1-3H3/b18-10+