4-(2-carboxyethyl)-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid

Systemtic Name: 4-(2-carboxyethyl)-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid Openeye Name: 4-(2-carboxyethyl)-3-oxo-1,4-benzoxazine-7-carboxylic acid CAS Name: 4-(2-carboxyethyl)-3-oxo-1,4-benzoxazine-7-carboxylic acid IUPAC Name: 4-(2-carboxyethyl)-3-oxo-1,4-benzoxazine-7-carboxylic acid Traditional Name: 4-(2-carboxyethyl)-3-keto-1,4-benzoxazine-7-carboxylic acid Formula: C12H11NO6 MolecularWeight: 265.21884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)O)CCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)O)CCC(=O)O

InChI

InChI=1S/C12H11NO6/c14-10-6-19-9-5-7(12(17)18)1-2-8(9)13(10)4-3-11(15)16/h1-2,5H,3-4,6H2,(H,15,16)(H,17,18)