2-[(3-bromophenyl)methyl]-2-(2-fluoranylethyl)propanedinitrile

Systemtic Name: 2-[(3-bromophenyl)methyl]-2-(2-fluoranylethyl)propanedinitrile Openeye Name: 2-[(3-bromophenyl)methyl]-2-(2-fluoroethyl)propanedinitrile CAS Name: 2-[(3-bromophenyl)methyl]-2-(2-fluoroethyl)propanedinitrile IUPAC Name: 2-[(3-bromophenyl)methyl]-2-(2-fluoroethyl)propanedinitrile Traditional Name: 2-(3-bromobenzyl)-2-(2-fluoroethyl)malononitrile Formula: C12H10BrFN2 MolecularWeight: 281.123603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CC(CCF)(C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CC(CCF)(C#N)C#N

InChI

InChI=1S/C12H10BrFN2/c13-11-3-1-2-10(6-11)7-12(8-15,9-16)4-5-14/h1-3,6H,4-5,7H2