(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C15H11BrN4O5 MolecularWeight: 407.17564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C15H11BrN4O5/c16-12-6-5-11(25-12)14(22)17-7-13(21)24-8-20-15(23)9-3-1-2-4-10(9)18-19-20/h1-6H,7-8H2,(H,17,22)