sodium 7-azanyl-4-(carboxymethyl)-2-oxidanylidene-chromene-3-sulfonate

Systemtic Name: sodium 7-azanyl-4-(carboxymethyl)-2-oxidanylidene-chromene-3-sulfonate Openeye Name: sodium 7-amino-4-(carboxymethyl)-2-oxo-chromene-3-sulfonate CAS Name: sodium 7-amino-4-(carboxymethyl)-2-oxo-1-benzopyran-3-sulfonate IUPAC Name: sodium 7-amino-4-(carboxymethyl)-2-oxochromene-3-sulfonate Traditional Name: sodium 7-amino-4-(carboxymethyl)-2-keto-chromene-3-sulfonate Formula: C11H8NNaO7S MolecularWeight: 321.23849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)OC(=O)C(=C2CC(=O)O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC2=C(C=C1N)OC(=O)C(=C2CC(=O)O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H9NO7S.Na/c12-5-1-2-6-7(4-9(13)14)10(20(16,17)18)11(15)19-8(6)3-5;/h1-3H,4,12H2,(H,13,14)(H,16,17,18);/q;+1/p-1