sodium 11-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]carbonylamino]undecanoate

Systemtic Name: sodium 11-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]carbonylamino]undecanoate Openeye Name: sodium 11-[(3,5-dichloro-2-hydroxy-benzoyl)amino]undecanoate CAS Name: sodium 11-[[(3,5-dichloro-2-hydroxyphenyl)-oxomethyl]amino]undecanoate IUPAC Name: sodium 11-[(3,5-dichloro-2-hydroxybenzoyl)amino]undecanoate Traditional Name: sodium 11-[(3,5-dichloro-2-hydroxy-benzoyl)amino]undecanoate Formula: C18H24Cl2NNaO4 MolecularWeight: 412.28323

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)O)C(=O)NCCCCCCCCCCC(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=C(C=C(C(=C1Cl)O)C(=O)NCCCCCCCCCCC(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C18H25Cl2NO4.Na/c19-13-11-14(17(24)15(20)12-13)18(25)21-10-8-6-4-2-1-3-5-7-9-16(22)23;/h11-12,24H,1-10H2,(H,21,25)(H,22,23);/q;+1/p-1