3-[(2-oxidanylidenechromen-6-yl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(2-oxidanylidenechromen-6-yl)sulfonylamino]butanoic acid Openeye Name: 3-[(2-oxochromen-6-yl)sulfonylamino]butanoic acid CAS Name: 3-[(2-oxo-1-benzopyran-6-yl)sulfonylamino]butanoic acid IUPAC Name: 3-[(2-oxochromen-6-yl)sulfonylamino]butanoic acid Traditional Name: 3-[(2-ketochromen-6-yl)sulfonylamino]butyric acid Formula: C13H13NO6S MolecularWeight: 311.31042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO6S/c1-8(6-12(15)16)14-21(18,19)10-3-4-11-9(7-10)2-5-13(17)20-11/h2-5,7-8,14H,6H2,1H3,(H,15,16)