N-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitro-phenyl)sulfonyl-cyclohexanecarboxamide

Systemtic Name: N-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitro-phenyl)sulfonyl-cyclohexanecarboxamide Openeye Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-N-(4-methyl-3-nitro-phenyl)sulfonyl-cyclohexanecarboxamide CAS Name: N-(3-acetyl-2-methyl-5-benzofuranyl)-N-(4-methyl-3-nitrophenyl)sulfonylcyclohexanecarboxamide IUPAC Name: N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitrophenyl)sulfonylcyclohexanecarboxamide Traditional Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-N-(4-methyl-3-nitro-phenyl)sulfonyl-cyclohexanecarboxamide Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)C)C)C(=O)C4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)C)C)C(=O)C4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O7S/c1-15-9-11-20(14-22(15)27(30)31)35(32,33)26(25(29)18-7-5-4-6-8-18)19-10-12-23-21(13-19)24(16(2)28)17(3)34-23/h9-14,18H,4-8H2,1-3H3