N-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)-3-nitro-N-(3-nitrophenyl)sulfonyl-benzamide

Systemtic Name: N-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)-3-nitro-N-(3-nitrophenyl)sulfonyl-benzamide Openeye Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-3-nitro-N-(3-nitrophenyl)sulfonyl-benzamide CAS Name: N-(3-acetyl-2-methyl-5-benzofuranyl)-3-nitro-N-(3-nitrophenyl)sulfonylbenzamide IUPAC Name: N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-3-nitro-N-(3-nitrophenyl)sulfonylbenzamide Traditional Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-3-nitro-N-(3-nitrophenyl)sulfonyl-benzamide Formula: C24H17N3O9S MolecularWeight: 523.47148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17N3O9S/c1-14(28)23-15(2)36-22-10-9-17(13-21(22)23)25(24(29)16-5-3-6-18(11-16)26(30)31)37(34,35)20-8-4-7-19(12-20)27(32)33/h3-13H,1-2H3