5-chloranyl-2-[(2-methylpropan-2-yl)oxycarbonyloxyamino]-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 5-chloranyl-2-[(2-methylpropan-2-yl)oxycarbonyloxyamino]-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-(tert-butoxycarbonyloxyamino)-5-chloro-1,3-benzothiazole-6-carboxylic acid CAS Name: 5-chloro-2-[[(2-methylpropan-2-yl)oxy-oxomethoxy]amino]-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 5-chloro-2-[(2-methylpropan-2-yl)oxycarbonyloxyamino]-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-(tert-butoxycarbonyloxyamino)-5-chloro-1,3-benzothiazole-6-carboxylic acid Formula: C13H13ClN2O5S MolecularWeight: 344.77072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)ONC1=NC2=C(S1)C=C(C(=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)ONC1=NC2=C(S1)C=C(C(=C2)Cl)C(=O)O

InChI

InChI=1S/C13H13ClN2O5S/c1-13(2,3)20-12(19)21-16-11-15-8-5-7(14)6(10(17)18)4-9(8)22-11/h4-5H,1-3H3,(H,15,16)(H,17,18)