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

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (E)-2-cyano-3-(p-tolyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methylphenyl)-2-propenoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(p-tolyl)acrylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C19H16FNO3 MolecularWeight: 325.333643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C19H16FNO3/c1-13-3-5-14(6-4-13)9-16(11-21)19(22)24-12-15-7-8-18(23-2)17(20)10-15/h3-10H,12H2,1-2H3/b16-9+