(E)-3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-ethoxy-phenyl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[4-(2-chloro-6-fluoro-benzyl)oxy-3-ethoxy-phenyl]-2-cyano-N-isopropyl-acrylamide Formula: C22H22ClFN2O3 MolecularWeight: 416.873083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC(C)C)OCC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC(C)C)OCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C22H22ClFN2O3/c1-4-28-21-11-15(10-16(12-25)22(27)26-14(2)3)8-9-20(21)29-13-17-18(23)6-5-7-19(17)24/h5-11,14H,4,13H2,1-3H3,(H,26,27)/b16-10+