(2E)-N-[2,3-dihydro-1-benzofuran-5-yl-(4-methylsulfonylphenyl)methyl]-3,7-dimethyl-octa-2,6-dienamide

Systemtic Name: (2E)-N-[2,3-dihydro-1-benzofuran-5-yl-(4-methylsulfonylphenyl)methyl]-3,7-dimethyl-octa-2,6-dienamide Openeye Name: (2E)-N-[2,3-dihydrobenzofuran-5-yl-(4-methylsulfonylphenyl)methyl]-3,7-dimethyl-octa-2,6-dienamide CAS Name: (2E)-N-[2,3-dihydrobenzofuran-5-yl-(4-methylsulfonylphenyl)methyl]-3,7-dimethylocta-2,6-dienamide IUPAC Name: (2E)-N-[2,3-dihydro-1-benzofuran-5-yl-(4-methylsulfonylphenyl)methyl]-3,7-dimethylocta-2,6-dienamide Traditional Name: (2E)-N-[coumaran-5-yl-(4-mesylphenyl)methyl]-3,7-dimethyl-octa-2,6-dienamide Formula: C26H31NO4S MolecularWeight: 453.59364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC(=O)NC(C1=CC=C(C=C1)S(=O)(=O)C)C2=CC3=C(C=C2)OCC3)C)C

Isomeric SMILES

CC(=CCC/C(=C/C(=O)NC(C1=CC=C(C=C1)S(=O)(=O)C)C2=CC3=C(C=C2)OCC3)/C)C

InChI

InChI=1S/C26H31NO4S/c1-18(2)6-5-7-19(3)16-25(28)27-26(20-8-11-23(12-9-20)32(4,29)30)22-10-13-24-21(17-22)14-15-31-24/h6,8-13,16-17,26H,5,7,14-15H2,1-4H3,(H,27,28)/b19-16+