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6-cyano-2-methoxycarbonyl-hexanoate

6-cyano-2-methoxycarbonyl-hexanoate

Systemtic Name:6-cyano-2-methoxycarbonyl-hexanoate
Openeye Name:6-cyano-2-methoxycarbonyl-hexanoate
CAS Name:6-cyano-2-methoxycarbonylhexanoate
IUPAC Name:6-cyano-2-methoxycarbonylhexanoate
Traditional Name:2-carbomethoxy-6-cyano-hexanoate
Formula: C9H12NO4-
MolecularWeight: 198.19588
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCC#N)C(=O)[O-]


Isomeric SMILES

COC(=O)C(CCCCC#N)C(=O)[O-]


InChI

InChI=1S/C9H13NO4/c1-14-9(13)7(8(11)12)5-3-2-4-6-10/h7H,2-5H2,1H3,(H,11,12)/p-1


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