(E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-methylsulfonyl-hept-5-enamide

Systemtic Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-methylsulfonyl-hept-5-enamide Openeye Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-methylsulfonyl-hept-5-enamide CAS Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-methylsulfonyl-5-heptenamide IUPAC Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-methylsulfonylhept-5-enamide Traditional Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-N-mesyl-hept-5-enamide Formula: C22H33NO5S MolecularWeight: 423.56612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(OCC(C(O1)C2=CC=CC=C2)CC=CCCCC(=O)NS(=O)(=O)C)CC

Isomeric SMILES

CCC1(OCC(C(O1)C2=CC=CC=C2)C/C=C/CCCC(=O)NS(=O)(=O)C)CC

InChI

InChI=1S/C22H33NO5S/c1-4-22(5-2)27-17-19(21(28-22)18-13-10-8-11-14-18)15-9-6-7-12-16-20(24)23-29(3,25)26/h6,8-11,13-14,19,21H,4-5,7,12,15-17H2,1-3H3,(H,23,24)/b9-6+