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

Systemtic Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(2-methylphenyl)-3-oxidanylidene-butanenitrile Openeye Name: 4-norbornan-2-yl-2-(o-tolyl)-3-oxo-butanenitrile CAS Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(2-methylphenyl)-3-oxobutanenitrile IUPAC Name: 4-(3-bicyclo[2.2.1]heptanyl)-2-(2-methylphenyl)-3-oxobutanenitrile Traditional Name: 3-keto-4-(2-norbornyl)-2-(o-tolyl)butyronitrile Formula: C18H21NO MolecularWeight: 267.36544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)C(=O)CC2CC3CCC2C3

Isomeric SMILES

CC1=CC=CC=C1C(C#N)C(=O)CC2CC3CCC2C3

InChI

InChI=1S/C18H21NO/c1-12-4-2-3-5-16(12)17(11-19)18(20)10-15-9-13-6-7-14(15)8-13/h2-5,13-15,17H,6-10H2,1H3