sodium 2-(2-chloranyloctanoyloxy)benzoate

Systemtic Name: sodium 2-(2-chloranyloctanoyloxy)benzoate Openeye Name: sodium 2-(2-chlorooctanoyloxy)benzoate CAS Name: sodium 2-(2-chloro-1-oxooctoxy)benzoate IUPAC Name: sodium 2-(2-chlorooctanoyloxy)benzoate Traditional Name: sodium 2-(2-chlorooctanoyloxy)benzoate Formula: C15H18ClNaO4 MolecularWeight: 320.74379

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC1=CC=CC=C1C(=O)[O-])Cl.[Na+]

Isomeric SMILES

CCCCCCC(C(=O)OC1=CC=CC=C1C(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C15H19ClO4.Na/c1-2-3-4-5-9-12(16)15(19)20-13-10-7-6-8-11(13)14(17)18;/h6-8,10,12H,2-5,9H2,1H3,(H,17,18);/q;+1/p-1