(8Z)-9-iodanyl-1-(4-methylphenyl)sulfonyl-3,4,5,6,7,10-hexahydro-2H-azecine

Systemtic Name: (8Z)-9-iodanyl-1-(4-methylphenyl)sulfonyl-3,4,5,6,7,10-hexahydro-2H-azecine Openeye Name: (8Z)-9-iodo-1-(p-tolylsulfonyl)-3,4,5,6,7,10-hexahydro-2H-azecine CAS Name: (8Z)-9-iodo-1-(4-methylphenyl)sulfonyl-3,4,5,6,7,10-hexahydro-2H-azecine IUPAC Name: (8Z)-9-iodo-1-(4-methylphenyl)sulfonyl-3,4,5,6,7,10-hexahydro-2H-azecine Traditional Name: (8Z)-9-iodo-1-tosyl-3,4,5,6,7,10-hexahydro-2H-azecine Formula: C16H22INO2S MolecularWeight: 419.32085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCCC=C(C2)I

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC/C=C(/C2)\I

InChI

InChI=1S/C16H22INO2S/c1-14-8-10-16(11-9-14)21(19,20)18-12-6-4-2-3-5-7-15(17)13-18/h7-11H,2-6,12-13H2,1H3/b15-7-