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ethyl (2S)-2-cyano-5-oxidanylidene-2-phenyl-hexanoate

ethyl (2S)-2-cyano-5-oxidanylidene-2-phenyl-hexanoate

Systemtic Name:ethyl (2S)-2-cyano-5-oxidanylidene-2-phenyl-hexanoate
Openeye Name:ethyl (2S)-2-cyano-5-oxo-2-phenyl-hexanoate
CAS Name:(2S)-2-cyano-5-oxo-2-phenylhexanoic acid ethyl ester
IUPAC Name:ethyl (2S)-2-cyano-5-oxo-2-phenylhexanoate
Traditional Name:(2S)-2-cyano-5-keto-2-phenyl-hexanoic acid ethyl ester
Formula: C15H17NO3
MolecularWeight: 259.30038
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

CCOC(=O)[C@](CCC(=O)C)(C#N)C1=CC=CC=C1


InChI

InChI=1S/C15H17NO3/c1-3-19-14(18)15(11-16,10-9-12(2)17)13-7-5-4-6-8-13/h4-8H,3,9-10H2,1-2H3/t15-/m1/s1


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