(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3-fluorophenyl)sulfonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3-fluorophenyl)sulfonylamino]ethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3-fluorophenyl)sulfonylamino]acetate CAS Name: 2-[(3-fluorophenyl)sulfonylamino]acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3-fluorophenyl)sulfonylamino]acetate Traditional Name: 2-[(3-fluorophenyl)sulfonylamino]acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C16H13FN4O5S MolecularWeight: 392.361623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C16H13FN4O5S/c17-11-4-3-5-12(8-11)27(24,25)18-9-15(22)26-10-21-16(23)13-6-1-2-7-14(13)19-20-21/h1-8,18H,9-10H2