1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate hydrate

Systemtic Name: 1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate hydrate Openeye Name: 1,1-dioxo-1,2-benzothiazol-3-olate hydrate CAS Name: 1,1-dioxo-1,2-benzothiazol-3-olate hydrate IUPAC Name: 1,1-dioxo-1,2-benzothiazol-3-olate hydrate Traditional Name: 1,1-diketo-1,2-benzothiazol-3-olate hydrate Formula: C7H6NO4S- MolecularWeight: 200.19184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5NO3S.H2O/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,9);1H2/p-1