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methyl 2-cyano-2-methyl-5-oxidanylidene-hexanoate

methyl 2-cyano-2-methyl-5-oxidanylidene-hexanoate

Systemtic Name:methyl 2-cyano-2-methyl-5-oxidanylidene-hexanoate
Openeye Name:methyl 2-cyano-2-methyl-5-oxo-hexanoate
CAS Name:2-cyano-2-methyl-5-oxohexanoic acid methyl ester
IUPAC Name:methyl 2-cyano-2-methyl-5-oxohexanoate
Traditional Name:2-cyano-5-keto-2-methyl-hexanoic acid methyl ester
Formula: C9H13NO3
MolecularWeight: 183.20442
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C)(C#N)C(=O)OC


Isomeric SMILES

CC(=O)CCC(C)(C#N)C(=O)OC


InChI

InChI=1S/C9H13NO3/c1-7(11)4-5-9(2,6-10)8(12)13-3/h4-5H2,1-3H3


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