2-bromanyl-3-chloranyl-6-(1H-indol-3-yloxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: 2-bromanyl-3-chloranyl-6-(1H-indol-3-yloxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: 2-bromo-3-chloro-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)tetrahydropyran-2-carboxylic acid CAS Name: 2-bromo-3-chloro-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)-2-oxanecarboxylic acid IUPAC Name: 2-bromo-3-chloro-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)oxane-2-carboxylic acid Traditional Name: 2-bromo-3-chloro-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)tetrahydropyran-2-carboxylic acid Formula: C14H13BrClNO7 MolecularWeight: 422.61252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)OC3C(C(C(C(O3)(C(=O)O)Br)(O)Cl)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)OC3C(C(C(C(O3)(C(=O)O)Br)(O)Cl)O)O

InChI

InChI=1S/C14H13BrClNO7/c15-13(12(20)21)14(16,22)10(19)9(18)11(24-13)23-8-5-17-7-4-2-1-3-6(7)8/h1-5,9-11,17-19,22H,(H,20,21)