1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate

Systemtic Name: 1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate Openeye Name: 1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate CAS Name: 1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate IUPAC Name: 1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate Traditional Name: 1-(3H-1,2-benzothiazol-2-yl)cyclodecane-1,2-diolate Formula: C17H23NO2S-2 MolecularWeight: 305.43502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(C(CCC1)[O-])(N2CC3=CC=CC=C3S2)[O-]

Isomeric SMILES

C1CCCCC(C(CCC1)[O-])(N2CC3=CC=CC=C3S2)[O-]

InChI

InChI=1S/C17H23NO2S/c19-16-11-5-3-1-2-4-8-12-17(16,20)18-13-14-9-6-7-10-15(14)21-18/h6-7,9-10,16H,1-5,8,11-13H2/q-2