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

Systemtic Name: 3-[4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoylamino]propanoic acid Openeye Name: 3-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]propanoic acid CAS Name: 3-[[1-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butyl]amino]propanoic acid IUPAC Name: 3-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]propanoic acid Traditional Name: 3-[4-(4-keto-1,2,3-benzotriazin-3-yl)butanoylamino]propionic acid Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCC(=O)NCCC(=O)O

InChI

InChI=1S/C14H16N4O4/c19-12(15-8-7-13(20)21)6-3-9-18-14(22)10-4-1-2-5-11(10)16-17-18/h1-2,4-5H,3,6-9H2,(H,15,19)(H,20,21)