5-[[(4-bromanyl-2-chloranyl-phenyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(4-bromanyl-2-chloranyl-phenyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[(4-bromo-2-chloro-anilino)methyl]furan-2-carboxylic acid CAS Name: 5-[(4-bromo-2-chloroanilino)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-bromo-2-chloroanilino)methyl]furan-2-carboxylic acid Traditional Name: 5-[(4-bromo-2-chloro-anilino)methyl]-2-furoic acid Formula: C12H9BrClNO3 MolecularWeight: 330.56176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)NCC2=CC=C(O2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)NCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H9BrClNO3/c13-7-1-3-10(9(14)5-7)15-6-8-2-4-11(18-8)12(16)17/h1-5,15H,6H2,(H,16,17)