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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-acetamidoethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-acetamidoacetate CAS Name: 2-acetamidoacetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-acetamidoacetate Traditional Name: 2-acetamidoacetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(=O)NCC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C12H12N4O4/c1-8(17)13-6-11(18)20-7-16-12(19)9-4-2-3-5-10(9)14-15-16/h2-5H,6-7H2,1H3,(H,13,17)