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

Systemtic Name: 3-[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]-2-(4-methylphenyl)prop-2-enenitrile Openeye Name: 3-[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]-2-(p-tolyl)prop-2-enenitrile CAS Name: 3-[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]-2-(4-methylphenyl)-2-propenenitrile IUPAC Name: 3-[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]-2-(4-methylphenyl)prop-2-enenitrile Traditional Name: 3-[3-bromo-4-(2-chlorobenzyl)oxy-5-ethoxy-phenyl]-2-(p-tolyl)acrylonitrile Formula: C25H21BrClNO2 MolecularWeight: 482.79674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C)Br)OCC3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C)Br)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C25H21BrClNO2/c1-3-29-24-14-18(12-21(15-28)19-10-8-17(2)9-11-19)13-22(26)25(24)30-16-20-6-4-5-7-23(20)27/h4-14H,3,16H2,1-2H3