3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoic acid

Systemtic Name: 3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoic acid Openeye Name: 3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoic acid CAS Name: 3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoic acid IUPAC Name: 3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoic acid Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-3-methyl-butyric acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)C(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)