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2-methyl-5-oxidanylidene-4-pyridin-4-yl-heptanenitrile

2-methyl-5-oxidanylidene-4-pyridin-4-yl-heptanenitrile

Systemtic Name:2-methyl-5-oxidanylidene-4-pyridin-4-yl-heptanenitrile
Openeye Name:2-methyl-5-oxo-4-(4-pyridyl)heptanenitrile
CAS Name:2-methyl-5-oxo-4-pyridin-4-ylheptanenitrile
IUPAC Name:2-methyl-5-oxo-4-pyridin-4-ylheptanenitrile
Traditional Name:5-keto-2-methyl-4-(4-pyridyl)enanthonitrile
Formula: C13H16N2O
MolecularWeight: 216.27894
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H16N2O/c1-3-13(16)12(8-10(2)9-14)11-4-6-15-7-5-11/h4-7,10,12H,3,8H2,1-2H3


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