4-chloranyl-N-(3-ethanoyl-2-methyl-benzo[g][1]benzofuran-5-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(3-ethanoyl-2-methyl-benzo[g][1]benzofuran-5-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(3-acetyl-2-methyl-benzo[g]benzofuran-5-yl)-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-(3-acetyl-2-methyl-5-benzo[g]benzofuranyl)-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-(3-acetyl-2-methylbenzo[g][1]benzofuran-5-yl)-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-(3-acetyl-2-methyl-benzo[g]benzofuran-5-yl)-4-chloro-3-nitro-benzenesulfonamide Formula: C21H15ClN2O6S MolecularWeight: 458.8716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C21H15ClN2O6S/c1-11(25)20-12(2)30-21-15-6-4-3-5-14(15)18(10-16(20)21)23-31(28,29)13-7-8-17(22)19(9-13)24(26)27/h3-10,23H,1-2H3