4-[4-(3-chloranylpropanoyloxy)butoxy]benzoic acid

Systemtic Name: 4-[4-(3-chloranylpropanoyloxy)butoxy]benzoic acid Openeye Name: 4-[4-(3-chloropropanoyloxy)butoxy]benzoic acid CAS Name: 4-[4-(3-chloro-1-oxopropoxy)butoxy]benzoic acid IUPAC Name: 4-[4-(3-chloropropanoyloxy)butoxy]benzoic acid Traditional Name: 4-[4-(3-chloropropanoyloxy)butoxy]benzoic acid Formula: C14H17ClO5 MolecularWeight: 300.73478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OCCCCOC(=O)CCCl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OCCCCOC(=O)CCCl

InChI

InChI=1S/C14H17ClO5/c15-8-7-13(16)20-10-2-1-9-19-12-5-3-11(4-6-12)14(17)18/h3-6H,1-2,7-10H2,(H,17,18)