(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-[(3,4-dimethoxyphenyl)sulfonylamino]benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C23H20N4O7S MolecularWeight: 496.4925

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCN3C(=O)C4=CC=CC=C4N=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCN3C(=O)C4=CC=CC=C4N=N3)OC

InChI

InChI=1S/C23H20N4O7S/c1-32-20-12-11-15(13-21(20)33-2)35(30,31)25-19-10-6-4-8-17(19)23(29)34-14-27-22(28)16-7-3-5-9-18(16)24-26-27/h3-13,25H,14H2,1-2H3