3-[2-(4-ethoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-N,N-diethyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-N,N-diethyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-oxo-ethyl]-N,N-diethyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-[2-(4-ethoxy-3-nitrophenyl)-2-oxoethyl]-N,N-diethyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-[2-(4-ethoxy-3-nitrophenyl)-2-oxoethyl]-N,N-diethyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-keto-ethyl]-N,N-diethyl-2-keto-1,3-benzoxazole-6-sulfonamide Formula: C21H23N3O8S MolecularWeight: 477.48762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=O)O2)CC(=O)C3=CC(=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=O)O2)CC(=O)C3=CC(=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O8S/c1-4-22(5-2)33(29,30)15-8-9-16-20(12-15)32-21(26)23(16)13-18(25)14-7-10-19(31-6-3)17(11-14)24(27)28/h7-12H,4-6,13H2,1-3H3