2-[(2H-1,4-benzoxazin-3-ylamino)methylidene]propanedioic acid

Systemtic Name: 2-[(2H-1,4-benzoxazin-3-ylamino)methylidene]propanedioic acid Openeye Name: 2-[(2H-1,4-benzoxazin-3-ylamino)methylene]propanedioic acid CAS Name: 2-[(2H-1,4-benzoxazin-3-ylamino)methylidene]propanedioic acid IUPAC Name: 2-[(2H-1,4-benzoxazin-3-ylamino)methylidene]propanedioic acid Traditional Name: 2-[(2H-1,4-benzoxazin-3-ylamino)methylene]malonic acid Formula: C12H10N2O5 MolecularWeight: 262.2182

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=CC=C2O1)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

C1C(=NC2=CC=CC=C2O1)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H10N2O5/c15-11(16)7(12(17)18)5-13-10-6-19-9-4-2-1-3-8(9)14-10/h1-5H,6H2,(H,13,14)(H,15,16)(H,17,18)