ethyl (E)-2-cyano-3-[(4-fluoranyl-2-methyl-phenyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(4-fluoranyl-2-methyl-phenyl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(4-fluoro-2-methyl-anilino)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-fluoro-2-methylanilino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(4-fluoro-2-methylanilino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-fluoro-2-methyl-anilino)acrylic acid ethyl ester Formula: C13H13FN2O2 MolecularWeight: 248.252923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=C(C=C1)F)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=C(C=C1)F)C)/C#N

InChI

InChI=1S/C13H13FN2O2/c1-3-18-13(17)10(7-15)8-16-12-5-4-11(14)6-9(12)2/h4-6,8,16H,3H2,1-2H3/b10-8+