(2R)-3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoate

Systemtic Name: (2R)-3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoate Openeye Name: (2R)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoate CAS Name: (2R)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoate IUPAC Name: (2R)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoate Traditional Name: (2R)-2-(4-keto-1,2,3-benzotriazin-3-yl)-3-methyl-butyrate Formula: C12H12N3O3- MolecularWeight: 246.24198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)[C@H](C(=O)[O-])N1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C12H13N3O3/c1-7(2)10(12(17)18)15-11(16)8-5-3-4-6-9(8)13-14-15/h3-7,10H,1-2H3,(H,17,18)/p-1/t10-/m1/s1