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5-oxidanylidene-4-(phenylmethyl)hexanenitrile

5-oxidanylidene-4-(phenylmethyl)hexanenitrile

Systemtic Name:5-oxidanylidene-4-(phenylmethyl)hexanenitrile
Openeye Name:4-benzyl-5-oxo-hexanenitrile
CAS Name:5-oxo-4-(phenylmethyl)hexanenitrile
IUPAC Name:4-benzyl-5-oxohexanenitrile
Traditional Name:4-benzyl-5-keto-hexanenitrile
Formula: C13H15NO
MolecularWeight: 201.2643
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC#N)CC1=CC=CC=C1


Isomeric SMILES

CC(=O)C(CCC#N)CC1=CC=CC=C1


InChI

InChI=1S/C13H15NO/c1-11(15)13(8-5-9-14)10-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8,10H2,1H3


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