6-chloranylhexyl 3-cyano-2-methyl-propanoate

Systemtic Name: 6-chloranylhexyl 3-cyano-2-methyl-propanoate Openeye Name: 6-chlorohexyl 3-cyano-2-methyl-propanoate CAS Name: 3-cyano-2-methylpropanoic acid 6-chlorohexyl ester IUPAC Name: 6-chlorohexyl 3-cyano-2-methylpropanoate Traditional Name: 3-cyano-2-methyl-propionic acid 6-chlorohexyl ester Formula: C11H18ClNO2 MolecularWeight: 231.71912

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(=O)OCCCCCCCl

Isomeric SMILES

CC(CC#N)C(=O)OCCCCCCCl

InChI

InChI=1S/C11H18ClNO2/c1-10(6-8-13)11(14)15-9-5-3-2-4-7-12/h10H,2-7,9H2,1H3