hexyl 4-chloranylbenzoate

Systemtic Name: hexyl 4-chloranylbenzoate Openeye Name: hexyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid hexyl ester IUPAC Name: hexyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid hexyl ester Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H17ClO2/c1-2-3-4-5-10-16-13(15)11-6-8-12(14)9-7-11/h6-9H,2-5,10H2,1H3