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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 4-[(4-ethoxyphenyl)sulfonylamino]benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-(p-phenetylsulfonylamino)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C23H20N4O6S MolecularWeight: 480.4931

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H20N4O6S/c1-2-32-18-11-13-19(14-12-18)34(30,31)25-17-9-7-16(8-10-17)23(29)33-15-27-22(28)20-5-3-4-6-21(20)24-26-27/h3-14,25H,2,15H2,1H3