chloromethyl 3-chloranyloctanoate

Systemtic Name: chloromethyl 3-chloranyloctanoate Openeye Name: chloromethyl 3-chlorooctanoate CAS Name: 3-chlorooctanoic acid chloromethyl ester IUPAC Name: chloromethyl 3-chlorooctanoate Traditional Name: 3-chlorocaprylic acid chloromethyl ester Formula: C9H16Cl2O2 MolecularWeight: 227.12814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)OCCl)Cl

Isomeric SMILES

CCCCCC(CC(=O)OCCl)Cl

InChI

InChI=1S/C9H16Cl2O2/c1-2-3-4-5-8(11)6-9(12)13-7-10/h8H,2-7H2,1H3