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

Systemtic Name: 2-[4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoylamino]ethanoate Openeye Name: 2-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]acetate CAS Name: 2-[[1-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butyl]amino]acetate IUPAC Name: 2-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]acetate Traditional Name: 2-[4-(4-keto-1,2,3-benzotriazin-3-yl)butanoylamino]acetate Formula: C13H13N4O4- MolecularWeight: 289.26672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCC(=O)NCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C13H14N4O4/c18-11(14-8-12(19)20)6-3-7-17-13(21)9-4-1-2-5-10(9)15-16-17/h1-2,4-5H,3,6-8H2,(H,14,18)(H,19,20)/p-1