diethyl 5-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylate CAS Name: 5-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C20H20N2O8S MolecularWeight: 448.4464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)C(=O)OCC

InChI

InChI=1S/C20H20N2O8S/c1-3-28-19(24)12-7-13(20(25)29-4-2)9-14(8-12)22-31(26,27)15-5-6-17-16(10-15)21-18(23)11-30-17/h5-10,22H,3-4,11H2,1-2H3,(H,21,23)