(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-hydroxy-4-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-4-(2-thienylsulfonylamino)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H14N4O6S2 MolecularWeight: 458.46766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CS4)O

InChI

InChI=1S/C19H14N4O6S2/c24-16-10-12(21-31(27,28)17-6-3-9-30-17)7-8-14(16)19(26)29-11-23-18(25)13-4-1-2-5-15(13)20-22-23/h1-10,21,24H,11H2