(NE)-N-[(4S,5R)-4-(1-iodanylethenyl)-5-pentyl-1,3-dioxolan-2-ylidene]-4-methyl-benzenesulfonamide

Systemtic Name: (NE)-N-[(4S,5R)-4-(1-iodanylethenyl)-5-pentyl-1,3-dioxolan-2-ylidene]-4-methyl-benzenesulfonamide Openeye Name: (NE)-N-[(4S,5R)-4-(1-iodovinyl)-5-pentyl-1,3-dioxolan-2-ylidene]-4-methyl-benzenesulfonamide CAS Name: (NE)-N-[(4S,5R)-4-(1-iodoethenyl)-5-pentyl-1,3-dioxolan-2-ylidene]-4-methylbenzenesulfonamide IUPAC Name: (NE)-N-[(4S,5R)-4-(1-iodoethenyl)-5-pentyl-1,3-dioxolan-2-ylidene]-4-methylbenzenesulfonamide Traditional Name: (NE)-N-[(4R,5S)-4-amyl-5-(1-iodovinyl)-1,3-dioxolan-2-ylidene]-4-methyl-benzenesulfonamide Formula: C17H22INO4S MolecularWeight: 463.33035

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(OC(=NS(=O)(=O)C2=CC=C(C=C2)C)O1)C(=C)I

Isomeric SMILES

CCCCC[C@@H]1[C@H](O/C(=N/S(=O)(=O)C2=CC=C(C=C2)C)/O1)C(=C)I

InChI

InChI=1S/C17H22INO4S/c1-4-5-6-7-15-16(13(3)18)23-17(22-15)19-24(20,21)14-10-8-12(2)9-11-14/h8-11,15-16H,3-7H2,1-2H3/b19-17+/t15-,16-/m1/s1