2,3-dimethyl-N-(2-morpholin-4-ylcarbonyl-1-benzofuran-3-yl)-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-(2-morpholin-4-ylcarbonyl-1-benzofuran-3-yl)-5-nitro-benzenesulfonamide Openeye Name: 2,3-dimethyl-N-[2-(morpholine-4-carbonyl)benzofuran-3-yl]-5-nitro-benzenesulfonamide CAS Name: 2,3-dimethyl-N-[2-[4-morpholinyl(oxo)methyl]-3-benzofuranyl]-5-nitrobenzenesulfonamide IUPAC Name: 2,3-dimethyl-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-5-nitrobenzenesulfonamide Traditional Name: 2,3-dimethyl-N-[2-(morpholine-4-carbonyl)benzofuran-3-yl]-5-nitro-benzenesulfonamide Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=C(OC3=CC=CC=C32)C(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=C(OC3=CC=CC=C32)C(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7S/c1-13-11-15(24(26)27)12-18(14(13)2)32(28,29)22-19-16-5-3-4-6-17(16)31-20(19)21(25)23-7-9-30-10-8-23/h3-6,11-12,22H,7-10H2,1-2H3