1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate; ethanedial

Systemtic Name: 1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate; ethanedial Openeye Name: 1,1-dioxo-1,2-benzothiazol-3-olate; oxaldehyde CAS Name: 1,1-dioxo-1,2-benzothiazol-3-olate; oxaldehyde IUPAC Name: 1,1-dioxo-1,2-benzothiazol-3-olate; oxaldehyde Traditional Name: 1,1-diketo-1,2-benzothiazol-3-olate; glyoxal Formula: C9H6NO5S- MolecularWeight: 240.21264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C(=O)C=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C(=O)C=O

InChI

InChI=1S/C7H5NO3S.C2H2O2/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;3-1-2-4/h1-4H,(H,8,9);1-2H/p-1