5-(6-bromanyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(6-bromanyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(6-bromo-3-oxo-4H-1,4-benzoxazin-7-yl)-5-oxo-pentanoic acid CAS Name: 5-(6-bromo-3-oxo-4H-1,4-benzoxazin-7-yl)-5-oxopentanoic acid IUPAC Name: 5-(6-bromo-3-oxo-4H-1,4-benzoxazin-7-yl)-5-oxopentanoic acid Traditional Name: 5-(6-bromo-3-keto-4H-1,4-benzoxazin-7-yl)-5-keto-valeric acid Formula: C13H12BrNO5 MolecularWeight: 342.14208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=C(C(=C2)Br)C(=O)CCCC(=O)O

Isomeric SMILES

C1C(=O)NC2=C(O1)C=C(C(=C2)Br)C(=O)CCCC(=O)O

InChI

InChI=1S/C13H12BrNO5/c14-8-5-9-11(20-6-12(17)15-9)4-7(8)10(16)2-1-3-13(18)19/h4-5H,1-3,6H2,(H,15,17)(H,18,19)