4-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamoyl]benzoic acid

Systemtic Name: 4-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamoyl]benzoic acid Openeye Name: 4-[(3,5-dibromo-4-hydroxy-phenyl)carbamoyl]benzoic acid CAS Name: 4-[(3,5-dibromo-4-hydroxyanilino)-oxomethyl]benzoic acid IUPAC Name: 4-[(3,5-dibromo-4-hydroxyphenyl)carbamoyl]benzoic acid Traditional Name: 4-[(3,5-dibromo-4-hydroxy-phenyl)carbamoyl]benzoic acid Formula: C14H9Br2NO4 MolecularWeight: 415.03356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC(=C(C(=C2)Br)O)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC(=C(C(=C2)Br)O)Br)C(=O)O

InChI

InChI=1S/C14H9Br2NO4/c15-10-5-9(6-11(16)12(10)18)17-13(19)7-1-3-8(4-2-7)14(20)21/h1-6,18H,(H,17,19)(H,20,21)