(E)-2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-1H-isoindol-1-yl]-3-ethoxy-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (E)-2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-1H-isoindol-1-yl]-3-ethoxy-3-oxidanyl-prop-2-enenitrile Openeye Name: (E)-2-[2-[(4-bromo-2-fluoro-phenyl)methyl]-3-oxo-isoindolin-1-yl]-3-ethoxy-3-hydroxy-prop-2-enenitrile CAS Name: (E)-2-[2-[(4-bromo-2-fluorophenyl)methyl]-3-oxo-1H-isoindol-1-yl]-3-ethoxy-3-hydroxy-2-propenenitrile IUPAC Name: (E)-2-[2-[(4-bromo-2-fluorophenyl)methyl]-3-oxo-1H-isoindol-1-yl]-3-ethoxy-3-hydroxyprop-2-enenitrile Traditional Name: (E)-2-[2-(4-bromo-2-fluoro-benzyl)-3-keto-isoindolin-1-yl]-3-ethoxy-3-hydroxy-acrylonitrile Formula: C20H16BrFN2O3 MolecularWeight: 431.255043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1C2=CC=CC=C2C(=O)N1CC3=C(C=C(C=C3)Br)F)O

Isomeric SMILES

CCO/C(=C(/C#N)\C1C2=CC=CC=C2C(=O)N1CC3=C(C=C(C=C3)Br)F)/O

InChI

InChI=1S/C20H16BrFN2O3/c1-2-27-20(26)16(10-23)18-14-5-3-4-6-15(14)19(25)24(18)11-12-7-8-13(21)9-17(12)22/h3-9,18,26H,2,11H2,1H3/b20-16-