3-(4-butan-2-yloxy-3-iodanyl-5-methoxy-phenyl)-2-(2-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-(4-butan-2-yloxy-3-iodanyl-5-methoxy-phenyl)-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 2-(2-fluorophenyl)-3-(3-iodo-5-methoxy-4-sec-butoxy-phenyl)prop-2-enenitrile CAS Name: 3-(4-butan-2-yloxy-3-iodo-5-methoxyphenyl)-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-(4-butan-2-yloxy-3-iodo-5-methoxyphenyl)-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 2-(2-fluorophenyl)-3-(3-iodo-5-methoxy-4-sec-butoxy-phenyl)acrylonitrile Formula: C20H19FINO2 MolecularWeight: 451.273233

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1I)C=C(C#N)C2=CC=CC=C2F)OC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1I)C=C(C#N)C2=CC=CC=C2F)OC

InChI

InChI=1S/C20H19FINO2/c1-4-13(2)25-20-18(22)10-14(11-19(20)24-3)9-15(12-23)16-7-5-6-8-17(16)21/h5-11,13H,4H2,1-3H3