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

Systemtic Name: N-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)-N-(4-methylphenyl)sulfonyl-cyclohexanecarboxamide Openeye Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-N-(p-tolylsulfonyl)cyclohexanecarboxamide CAS Name: N-(3-acetyl-2-methyl-5-benzofuranyl)-N-(4-methylphenyl)sulfonylcyclohexanecarboxamide IUPAC Name: N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methylphenyl)sulfonylcyclohexanecarboxamide Traditional Name: N-(3-acetyl-2-methyl-benzofuran-5-yl)-N-tosyl-cyclohexanecarboxamide Formula: C25H27NO5S MolecularWeight: 453.55058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)C)C)C(=O)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)C)C)C(=O)C4CCCCC4

InChI

InChI=1S/C25H27NO5S/c1-16-9-12-21(13-10-16)32(29,30)26(25(28)19-7-5-4-6-8-19)20-11-14-23-22(15-20)24(17(2)27)18(3)31-23/h9-15,19H,4-8H2,1-3H3