2-[(5-nitro-2-oxidanylidene-1,3-dihydroindol-6-yl)sulfanyl]propanoic acid

Systemtic Name: 2-[(5-nitro-2-oxidanylidene-1,3-dihydroindol-6-yl)sulfanyl]propanoic acid Openeye Name: 2-(5-nitro-2-oxo-indolin-6-yl)sulfanylpropanoic acid CAS Name: 2-[(5-nitro-2-oxo-1,3-dihydroindol-6-yl)thio]propanoic acid IUPAC Name: 2-[(5-nitro-2-oxo-1,3-dihydroindol-6-yl)sulfanyl]propanoic acid Traditional Name: 2-[(2-keto-5-nitro-indolin-6-yl)thio]propionic acid Formula: C11H10N2O5S MolecularWeight: 282.2725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=C(C=C2CC(=O)NC2=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)SC1=C(C=C2CC(=O)NC2=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O5S/c1-5(11(15)16)19-9-4-7-6(3-10(14)12-7)2-8(9)13(17)18/h2,4-5H,3H2,1H3,(H,12,14)(H,15,16)