sodium 2-[2-azanyl-3-(4-bromanyl-2-chloranyl-phenyl)carbonyl-5-chloranyl-phenyl]ethanoate

Systemtic Name: sodium 2-[2-azanyl-3-(4-bromanyl-2-chloranyl-phenyl)carbonyl-5-chloranyl-phenyl]ethanoate Openeye Name: sodium 2-[2-amino-3-(4-bromo-2-chloro-benzoyl)-5-chloro-phenyl]acetate CAS Name: sodium 2-[2-amino-3-[(4-bromo-2-chlorophenyl)-oxomethyl]-5-chlorophenyl]acetate IUPAC Name: sodium 2-[2-amino-3-(4-bromo-2-chlorobenzoyl)-5-chlorophenyl]acetate Traditional Name: sodium 2-[2-amino-3-(4-bromo-2-chloro-benzoyl)-5-chloro-phenyl]acetate Formula: C15H9BrCl2NNaO3 MolecularWeight: 425.03663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)C(=O)C2=CC(=CC(=C2N)CC(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)C(=O)C2=CC(=CC(=C2N)CC(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C15H10BrCl2NO3.Na/c16-8-1-2-10(12(18)5-8)15(22)11-6-9(17)3-7(14(11)19)4-13(20)21;/h1-3,5-6H,4,19H2,(H,20,21);/q;+1/p-1