(2S)-2-oxidanyl-2-(2-oxidanylideneethyl)butanedioic acid hydrate

Systemtic Name: (2S)-2-oxidanyl-2-(2-oxidanylideneethyl)butanedioic acid hydrate Openeye Name: (2S)-2-hydroxy-2-(2-oxoethyl)butanedioic acid hydrate CAS Name: (2S)-2-hydroxy-2-(2-oxoethyl)butanedioic acid hydrate IUPAC Name: (2S)-2-hydroxy-2-(2-oxoethyl)butanedioic acid hydrate Traditional Name: (2S)-2-hydroxy-2-(2-ketoethyl)succinic acid hydrate Formula: C6H10O7 MolecularWeight: 194.1394

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Descriptors Computed from Structure

Canonical SMILES:

C(C=O)C(CC(=O)O)(C(=O)O)O.O

Isomeric SMILES

C(C=O)[C@](CC(=O)O)(C(=O)O)O.O

InChI

InChI=1S/C6H8O6.H2O/c7-2-1-6(12,5(10)11)3-4(8)9;/h2,12H,1,3H2,(H,8,9)(H,10,11);1H2/t6-;/m0./s1