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

Systemtic Name: 3-[2-bromanyl-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[2-bromo-5-ethoxy-4-(m-tolylmethoxy)phenyl]-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-[2-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[2-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[2-bromo-5-ethoxy-4-(3-methylbenzyl)oxy-phenyl]-2-(2-fluorophenyl)acrylonitrile Formula: C25H21BrFNO2 MolecularWeight: 466.342143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C(C#N)C2=CC=CC=C2F)Br)OCC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C=C(C#N)C2=CC=CC=C2F)Br)OCC3=CC=CC(=C3)C

InChI

InChI=1S/C25H21BrFNO2/c1-3-29-24-13-19(12-20(15-28)21-9-4-5-10-23(21)27)22(26)14-25(24)30-16-18-8-6-7-17(2)11-18/h4-14H,3,16H2,1-2H3