2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylamino]propanoic acid

Systemtic Name: 2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylamino]propanoic acid Openeye Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylamino]propanoic acid CAS Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylamino]propanoic acid IUPAC Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylamino]propanoic acid Traditional Name: 2-[(4-keto-1,2,3-benzotriazin-3-yl)methylamino]propionic acid Formula: C11H12N4O3 MolecularWeight: 248.23798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C(=O)O)NCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C11H12N4O3/c1-7(11(17)18)12-6-15-10(16)8-4-2-3-5-9(8)13-14-15/h2-5,7,12H,6H2,1H3,(H,17,18)