(E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cycloheptyl-3-[3-ethoxy-4-(4-fluorobenzyl)oxy-phenyl]acrylamide Formula: C26H29FN2O3 MolecularWeight: 436.518463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2CCCCCC2)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2CCCCCC2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C26H29FN2O3/c1-2-31-25-16-20(11-14-24(25)32-18-19-9-12-22(27)13-10-19)15-21(17-28)26(30)29-23-7-5-3-4-6-8-23/h9-16,23H,2-8,18H2,1H3,(H,29,30)/b21-15+