3-[(1-ethyl-2-oxidanylidene-3H-indol-5-yl)sulfonyl]propanoic acid

Systemtic Name: 3-[(1-ethyl-2-oxidanylidene-3H-indol-5-yl)sulfonyl]propanoic acid Openeye Name: 3-(1-ethyl-2-oxo-indolin-5-yl)sulfonylpropanoic acid CAS Name: 3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanoic acid IUPAC Name: 3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanoic acid Traditional Name: 3-(1-ethyl-2-keto-indolin-5-yl)sulfonylpropionic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)O

Isomeric SMILES

CCN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C13H15NO5S/c1-2-14-11-4-3-10(7-9(11)8-12(14)15)20(18,19)6-5-13(16)17/h3-4,7H,2,5-6,8H2,1H3,(H,16,17)