(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methylbenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(diethylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methyl-benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)C

InChI

InChI=1S/C20H22N4O5S/c1-4-23(5-2)30(27,28)18-12-15(11-10-14(18)3)20(26)29-13-24-19(25)16-8-6-7-9-17(16)21-22-24/h6-12H,4-5,13H2,1-3H3