1-(phenylmethyl)-5-(phenylsulfonyl)-1,5-diazocane-3,7-diol

Systemtic Name: 1-(phenylmethyl)-5-(phenylsulfonyl)-1,5-diazocane-3,7-diol Openeye Name: 1-(benzenesulfonyl)-5-benzyl-1,5-diazocane-3,7-diol CAS Name: 1-(benzenesulfonyl)-5-(phenylmethyl)-1,5-diazocane-3,7-diol IUPAC Name: 1-(benzenesulfonyl)-5-benzyl-1,5-diazocane-3,7-diol Traditional Name: 1-benzyl-5-besyl-1,5-diazocane-3,7-diol Formula: C19H24N2O4S MolecularWeight: 376.46986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC(CN1CC2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

C1C(CN(CC(CN1CC2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H24N2O4S/c22-17-12-20(11-16-7-3-1-4-8-16)13-18(23)15-21(14-17)26(24,25)19-9-5-2-6-10-19/h1-10,17-18,22-23H,11-15H2