4-(3-bicyclo[2.2.1]heptanyl)-2-(3-bromophenyl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(3-bromophenyl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(3-bromophenyl)-4-norbornan-2-yl-3-oxo-butanenitrile CAS Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(3-bromophenyl)-3-oxobutanenitrile IUPAC Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(3-bromophenyl)-3-oxobutanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-4-(2-norbornyl)butyronitrile Formula: C17H18BrNO MolecularWeight: 332.23492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2CC(=O)C(C#N)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CC2CC1CC2CC(=O)C(C#N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H18BrNO/c18-15-3-1-2-13(8-15)16(10-19)17(20)9-14-7-11-4-5-12(14)6-11/h1-3,8,11-12,14,16H,4-7,9H2