(1-chloranyl-4-methyl-nonan-4-yl) ethanoate

Systemtic Name: (1-chloranyl-4-methyl-nonan-4-yl) ethanoate Openeye Name: [1-(3-chloropropyl)-1-methyl-hexyl] acetate CAS Name: acetic acid (1-chloro-4-methylnonan-4-yl) ester IUPAC Name: (1-chloro-4-methylnonan-4-yl) acetate Traditional Name: acetic acid [1-(3-chloropropyl)-1-methyl-hexyl] ester Formula: C12H23ClO2 MolecularWeight: 234.76282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(CCCCl)OC(=O)C

Isomeric SMILES

CCCCCC(C)(CCCCl)OC(=O)C

InChI

InChI=1S/C12H23ClO2/c1-4-5-6-8-12(3,9-7-10-13)15-11(2)14/h4-10H2,1-3H3