5-chloranylpentan-2-yl benzoate

Systemtic Name: 5-chloranylpentan-2-yl benzoate Openeye Name: (4-chloro-1-methyl-butyl) benzoate CAS Name: benzoic acid 5-chloropentan-2-yl ester IUPAC Name: 5-chloropentan-2-yl benzoate Traditional Name: benzoic acid (4-chloro-1-methyl-butyl) ester Formula: C12H15ClO2 MolecularWeight: 226.6993

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCl)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(CCCCl)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H15ClO2/c1-10(6-5-9-13)15-12(14)11-7-3-2-4-8-11/h2-4,7-8,10H,5-6,9H2,1H3