N-(7-chloranyl-3-ethanoyl-2-methyl-1-benzofuran-5-yl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(7-chloranyl-3-ethanoyl-2-methyl-1-benzofuran-5-yl)-4-nitro-benzenesulfonamide Openeye Name: N-(3-acetyl-7-chloro-2-methyl-benzofuran-5-yl)-4-nitro-benzenesulfonamide CAS Name: N-(3-acetyl-7-chloro-2-methyl-5-benzofuranyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(3-acetyl-7-chloro-2-methyl-1-benzofuran-5-yl)-4-nitrobenzenesulfonamide Traditional Name: N-(3-acetyl-7-chloro-2-methyl-benzofuran-5-yl)-4-nitro-benzenesulfonamide Formula: C17H13ClN2O6S MolecularWeight: 408.81292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CC(=C2O1)Cl)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C2=CC(=CC(=C2O1)Cl)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C17H13ClN2O6S/c1-9(21)16-10(2)26-17-14(16)7-11(8-15(17)18)19-27(24,25)13-5-3-12(4-6-13)20(22)23/h3-8,19H,1-2H3