3-[3-ethoxy-4-[(4-methylphenyl)methoxy]-5-prop-2-enyl-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]-5-prop-2-enyl-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[3-allyl-5-ethoxy-4-(p-tolylmethoxy)phenyl]-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]-5-prop-2-enylphenyl]-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]-5-prop-2-enylphenyl]-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[3-allyl-5-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-2-(2-fluorophenyl)acrylonitrile Formula: C28H26FNO2 MolecularWeight: 427.509943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C)CC=C)C=C(C#N)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C)CC=C)C=C(C#N)C3=CC=CC=C3F

InChI

InChI=1S/C28H26FNO2/c1-4-8-23-15-22(16-24(18-30)25-9-6-7-10-26(25)29)17-27(31-5-2)28(23)32-19-21-13-11-20(3)12-14-21/h4,6-7,9-17H,1,5,8,19H2,2-3H3