cyanomethyl (3R)-3-methyl-4-oxidanylidene-nonanoate

Systemtic Name: cyanomethyl (3R)-3-methyl-4-oxidanylidene-nonanoate Openeye Name: cyanomethyl (3R)-3-methyl-4-oxo-nonanoate CAS Name: (3R)-3-methyl-4-oxononanoic acid cyanomethyl ester IUPAC Name: cyanomethyl (3R)-3-methyl-4-oxononanoate Traditional Name: (3R)-4-keto-3-methyl-pelargonic acid cyanomethyl ester Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C)CC(=O)OCC#N

Isomeric SMILES

CCCCCC(=O)[C@H](C)CC(=O)OCC#N

InChI

InChI=1S/C12H19NO3/c1-3-4-5-6-11(14)10(2)9-12(15)16-8-7-13/h10H,3-6,8-9H2,1-2H3/t10-/m1/s1