5-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-2-(propanoylamino)benzoic acid

Systemtic Name: 5-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-2-(propanoylamino)benzoic acid Openeye Name: 5-[(2-bromo-4-chloro-phenoxy)methyl]-2-(propanoylamino)benzoic acid CAS Name: 5-[(2-bromo-4-chlorophenoxy)methyl]-2-(1-oxopropylamino)benzoic acid IUPAC Name: 5-[(2-bromo-4-chlorophenoxy)methyl]-2-(propanoylamino)benzoic acid Traditional Name: 5-[(2-bromo-4-chloro-phenoxy)methyl]-2-propionamido-benzoic acid Formula: C17H15BrClNO4 MolecularWeight: 412.6623

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)COC2=C(C=C(C=C2)Cl)Br)C(=O)O

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)COC2=C(C=C(C=C2)Cl)Br)C(=O)O

InChI

InChI=1S/C17H15BrClNO4/c1-2-16(21)20-14-5-3-10(7-12(14)17(22)23)9-24-15-6-4-11(19)8-13(15)18/h3-8H,2,9H2,1H3,(H,20,21)(H,22,23)