(E)-3-[2-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[2-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-[2-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[2-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: (E)-3-[2-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[2-bromo-4-(2-fluorobenzyl)oxy-5-methoxy-phenyl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C22H20BrFN2O4 MolecularWeight: 475.307603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)N2CCOCC2)Br)OCC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)N2CCOCC2)Br)OCC3=CC=CC=C3F

InChI

InChI=1S/C22H20BrFN2O4/c1-28-20-11-16(10-17(13-25)22(27)26-6-8-29-9-7-26)18(23)12-21(20)30-14-15-4-2-3-5-19(15)24/h2-5,10-12H,6-9,14H2,1H3/b17-10+