(E)-2-cyano-N-(2-fluorophenyl)-3-[4-(3-methylbutoxy)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2-fluorophenyl)-3-[4-(3-methylbutoxy)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(2-fluorophenyl)-3-(4-isopentyloxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2-fluorophenyl)-3-[4-(3-methylbutoxy)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-fluorophenyl)-3-[4-(3-methylbutoxy)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(2-fluorophenyl)-3-(4-isoamoxyphenyl)acrylamide Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C21H21FN2O2/c1-15(2)11-12-26-18-9-7-16(8-10-18)13-17(14-23)21(25)24-20-6-4-3-5-19(20)22/h3-10,13,15H,11-12H2,1-2H3,(H,24,25)/b17-13+