4-oxidanylidene-2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]piperidine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]piperidine-1-carboxylic acid Openeye Name: 4-oxo-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]piperidine-1-carboxylic acid CAS Name: 4-oxo-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-1-piperidinecarboxylic acid IUPAC Name: 4-oxo-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]piperidine-1-carboxylic acid Traditional Name: 4-keto-2-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]piperidine-1-carboxylic acid Formula: C14H14N2O6S MolecularWeight: 338.33576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C(=O)O

Isomeric SMILES

C1CN(C(CC1=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C(=O)O

InChI

InChI=1S/C14H14N2O6S/c17-10-5-6-15(14(19)20)9(7-10)8-16-13(18)11-3-1-2-4-12(11)23(16,21)22/h1-4,9H,5-8H2,(H,19,20)