sodium 4-oxidanyl-4-(2-oxidanylidene-1,3-dihydroindol-5-yl)butanoate

Systemtic Name: sodium 4-oxidanyl-4-(2-oxidanylidene-1,3-dihydroindol-5-yl)butanoate Openeye Name: sodium 4-hydroxy-4-(2-oxoindolin-5-yl)butanoate CAS Name: sodium 4-hydroxy-4-(2-oxo-1,3-dihydroindol-5-yl)butanoate IUPAC Name: sodium 4-hydroxy-4-(2-oxo-1,3-dihydroindol-5-yl)butanoate Traditional Name: sodium 4-hydroxy-4-(2-ketoindolin-5-yl)butyrate Formula: C12H12NNaO4 MolecularWeight: 257.21775

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C(CCC(=O)[O-])O)NC1=O.[Na+]

Isomeric SMILES

C1C2=C(C=CC(=C2)C(CCC(=O)[O-])O)NC1=O.[Na+]

InChI

InChI=1S/C12H13NO4.Na/c14-10(3-4-12(16)17)7-1-2-9-8(5-7)6-11(15)13-9;/h1-2,5,10,14H,3-4,6H2,(H,13,15)(H,16,17);/q;+1/p-1