(2-oxidanylidene-2-phenylazanyl-ethyl) 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Openeye Name: (2-anilino-2-oxo-ethyl) 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid (2-anilino-2-keto-ethyl) ester Formula: C23H20N2O7S MolecularWeight: 468.4791

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O7S/c26-22(24-17-4-2-1-3-5-17)15-32-23(27)16-6-8-18(9-7-16)25-33(28,29)19-10-11-20-21(14-19)31-13-12-30-20/h1-11,14,25H,12-13,15H2,(H,24,26)