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

Systemtic Name: 3-[4-[(4-bromophenyl)methoxy]-3-ethoxy-5-prop-2-enyl-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[3-allyl-4-[(4-bromophenyl)methoxy]-5-ethoxy-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-[4-[(4-bromophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[4-[(4-bromophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[3-allyl-4-(4-bromobenzyl)oxy-5-ethoxy-phenyl]-2-(2-fluorophenyl)acrylonitrile Formula: C27H23BrFNO2 MolecularWeight: 492.379423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23BrFNO2/c1-3-7-21-14-20(15-22(17-30)24-8-5-6-9-25(24)29)16-26(31-4-2)27(21)32-18-19-10-12-23(28)13-11-19/h3,5-6,8-16H,1,4,7,18H2,2H3