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2-cyanoethyl 3-oxidanylideneoctanoate

2-cyanoethyl 3-oxidanylideneoctanoate

Systemtic Name:2-cyanoethyl 3-oxidanylideneoctanoate
Openeye Name:2-cyanoethyl 3-oxooctanoate
CAS Name:3-oxooctanoic acid 2-cyanoethyl ester
IUPAC Name:2-cyanoethyl 3-oxooctanoate
Traditional Name:3-ketocaprylic acid 2-cyanoethyl ester
Formula: C11H17NO3
MolecularWeight: 211.25758
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)OCCC#N


Isomeric SMILES

CCCCCC(=O)CC(=O)OCCC#N


InChI

InChI=1S/C11H17NO3/c1-2-3-4-6-10(13)9-11(14)15-8-5-7-12/h2-6,8-9H2,1H3


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