2,4-bis(chloranyl)-5-(hexanoylamino)benzoate

Systemtic Name: 2,4-bis(chloranyl)-5-(hexanoylamino)benzoate Openeye Name: 2,4-dichloro-5-(hexanoylamino)benzoate CAS Name: 2,4-dichloro-5-(1-oxohexylamino)benzoate IUPAC Name: 2,4-dichloro-5-(hexanoylamino)benzoate Traditional Name: 5-(caproylamino)-2,4-dichloro-benzoate Formula: C13H14Cl2NO3- MolecularWeight: 303.16116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=C(C=C(C(=C1)C(=O)[O-])Cl)Cl

Isomeric SMILES

CCCCCC(=O)NC1=C(C=C(C(=C1)C(=O)[O-])Cl)Cl

InChI

InChI=1S/C13H15Cl2NO3/c1-2-3-4-5-12(17)16-11-6-8(13(18)19)9(14)7-10(11)15/h6-7H,2-5H2,1H3,(H,16,17)(H,18,19)/p-1