2-[(2-oxidanylidenechromen-6-yl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(2-oxidanylidenechromen-6-yl)sulfonylamino]butanoic acid Openeye Name: 2-[(2-oxochromen-6-yl)sulfonylamino]butanoic acid CAS Name: 2-[(2-oxo-1-benzopyran-6-yl)sulfonylamino]butanoic acid IUPAC Name: 2-[(2-oxochromen-6-yl)sulfonylamino]butanoic acid Traditional Name: 2-[(2-ketochromen-6-yl)sulfonylamino]butyric acid Formula: C13H13NO6S MolecularWeight: 311.31042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C=C2

Isomeric SMILES

CCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C=C2

InChI

InChI=1S/C13H13NO6S/c1-2-10(13(16)17)14-21(18,19)9-4-5-11-8(7-9)3-6-12(15)20-11/h3-7,10,14H,2H2,1H3,(H,16,17)