2-(5-bromanyl-1-benzofuran-2-yl)-6-chloranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-bromanyl-1-benzofuran-2-yl)-6-chloranyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-bromobenzofuran-2-yl)-6-chloro-quinoline-4-carboxylic acid CAS Name: 2-(5-bromo-2-benzofuranyl)-6-chloro-4-quinolinecarboxylic acid IUPAC Name: 2-(5-bromo-1-benzofuran-2-yl)-6-chloroquinoline-4-carboxylic acid Traditional Name: 2-(5-bromobenzofuran-2-yl)-6-chloro-cinchoninic acid Formula: C18H9BrClNO3 MolecularWeight: 402.62596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=CC(=N2)C3=CC4=C(O3)C=CC(=C4)Br)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=CC(=N2)C3=CC4=C(O3)C=CC(=C4)Br)C(=O)O

InChI

InChI=1S/C18H9BrClNO3/c19-10-1-4-16-9(5-10)6-17(24-16)15-8-13(18(22)23)12-7-11(20)2-3-14(12)21-15/h1-8H,(H,22,23)