2-[[(7-iodanyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(7-iodanyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(7-iodo-2H-1,4-benzoxazin-3-yl)amino]methylene]propanedioic acid CAS Name: 2-[[(7-iodo-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(7-iodo-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(7-iodo-2H-1,4-benzoxazin-3-yl)amino]methylene]malonic acid Formula: C12H9IN2O5 MolecularWeight: 388.11473

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(O1)C=C(C=C2)I)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

C1C(=NC2=C(O1)C=C(C=C2)I)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H9IN2O5/c13-6-1-2-8-9(3-6)20-5-10(15-8)14-4-7(11(16)17)12(18)19/h1-4H,5H2,(H,14,15)(H,16,17)(H,18,19)