(1-chloranyloxy-3-methyl-1-oxidanylidene-butan-2-yl) benzotriazole-1-carboxylate

Systemtic Name: (1-chloranyloxy-3-methyl-1-oxidanylidene-butan-2-yl) benzotriazole-1-carboxylate Openeye Name: (1-chlorooxycarbonyl-2-methyl-propyl) benzotriazole-1-carboxylate CAS Name: 1-benzotriazolecarboxylic acid (1-chlorooxy-3-methyl-1-oxobutan-2-yl) ester IUPAC Name: (1-chlorooxy-3-methyl-1-oxobutan-2-yl) benzotriazole-1-carboxylate Traditional Name: benzotriazole-1-carboxylic acid (1-chlorooxycarbonyl-2-methyl-propyl) ester Formula: C12H12ClN3O4 MolecularWeight: 297.69438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCl)OC(=O)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)C(C(=O)OCl)OC(=O)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C12H12ClN3O4/c1-7(2)10(11(17)20-13)19-12(18)16-9-6-4-3-5-8(9)14-15-16/h3-7,10H,1-2H3