1,5-bis-(4-methylphenyl)sulfonyl-1,5-diazocan-3-ol

Systemtic Name: 1,5-bis-(4-methylphenyl)sulfonyl-1,5-diazocan-3-ol Openeye Name: 1,5-bis(p-tolylsulfonyl)-1,5-diazocan-3-ol CAS Name: 1,5-bis-(4-methylphenyl)sulfonyl-1,5-diazocan-3-ol IUPAC Name: 1,5-bis-(4-methylphenyl)sulfonyl-1,5-diazocan-3-ol Traditional Name: 1,5-ditosyl-1,5-diazocan-3-ol Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC(C2)O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC(C2)O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H26N2O5S2/c1-16-4-8-19(9-5-16)28(24,25)21-12-3-13-22(15-18(23)14-21)29(26,27)20-10-6-17(2)7-11-20/h4-11,18,23H,3,12-15H2,1-2H3