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methyl 2-cyano-3-pentyl-octanoate

methyl 2-cyano-3-pentyl-octanoate

Systemtic Name:methyl 2-cyano-3-pentyl-octanoate
Openeye Name:methyl 2-cyano-3-pentyl-octanoate
CAS Name:2-cyano-3-pentyloctanoic acid methyl ester
IUPAC Name:methyl 2-cyano-3-pentyloctanoate
Traditional Name:3-amyl-2-cyano-caprylic acid methyl ester
Formula: C15H27NO2
MolecularWeight: 253.38038
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCCC)C(C#N)C(=O)OC


Isomeric SMILES

CCCCCC(CCCCC)C(C#N)C(=O)OC


InChI

InChI=1S/C15H27NO2/c1-4-6-8-10-13(11-9-7-5-2)14(12-16)15(17)18-3/h13-14H,4-11H2,1-3H3


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