sodium 4-(2-chloranyloctanoyloxy)benzoate

Systemtic Name: sodium 4-(2-chloranyloctanoyloxy)benzoate Openeye Name: sodium 4-(2-chlorooctanoyloxy)benzoate CAS Name: sodium 4-(2-chloro-1-oxooctoxy)benzoate IUPAC Name: sodium 4-(2-chlorooctanoyloxy)benzoate Traditional Name: sodium 4-(2-chlorooctanoyloxy)benzoate Formula: C15H18ClNaO4 MolecularWeight: 320.74379

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC1=CC=C(C=C1)C(=O)[O-])Cl.[Na+]

Isomeric SMILES

CCCCCCC(C(=O)OC1=CC=C(C=C1)C(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C15H19ClO4.Na/c1-2-3-4-5-6-13(16)15(19)20-12-9-7-11(8-10-12)14(17)18;/h7-10,13H,2-6H2,1H3,(H,17,18);/q;+1/p-1