2-(4-bromophenyl)-3-(5-chloranyl-2-hexoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(4-bromophenyl)-3-(5-chloranyl-2-hexoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(4-bromophenyl)-3-(5-chloro-2-hexoxy-phenyl)prop-2-enenitrile CAS Name: 2-(4-bromophenyl)-3-(5-chloro-2-hexoxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-bromophenyl)-3-(5-chloro-2-hexoxyphenyl)prop-2-enenitrile Traditional Name: 2-(4-bromophenyl)-3-(5-chloro-2-hexoxy-phenyl)acrylonitrile Formula: C21H21BrClNO MolecularWeight: 418.75454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Cl)C=C(C#N)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Cl)C=C(C#N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C21H21BrClNO/c1-2-3-4-5-12-25-21-11-10-20(23)14-17(21)13-18(15-24)16-6-8-19(22)9-7-16/h6-11,13-14H,2-5,12H2,1H3