4-[4-oxidanyl-3,5-bis(piperidin-1-ylmethyl)phenyl]sulfonyl-2,6-bis(piperidin-1-ylmethyl)phenol

Systemtic Name: 4-[4-oxidanyl-3,5-bis(piperidin-1-ylmethyl)phenyl]sulfonyl-2,6-bis(piperidin-1-ylmethyl)phenol Openeye Name: 4-[4-hydroxy-3,5-bis(1-piperidylmethyl)phenyl]sulfonyl-2,6-bis(1-piperidylmethyl)phenol CAS Name: 4-[4-hydroxy-3,5-bis(1-piperidinylmethyl)phenyl]sulfonyl-2,6-bis(1-piperidinylmethyl)phenol IUPAC Name: 4-[4-hydroxy-3,5-bis(piperidin-1-ylmethyl)phenyl]sulfonyl-2,6-bis(piperidin-1-ylmethyl)phenol Traditional Name: 4-[4-hydroxy-3,5-bis(piperidinomethyl)phenyl]sulfonyl-2,6-bis(piperidinomethyl)phenol Formula: C36H54N4O4S MolecularWeight: 638.90336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCCCC3)S(=O)(=O)C4=CC(=C(C(=C4)CN5CCCCC5)O)CN6CCCCC6

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCCCC3)S(=O)(=O)C4=CC(=C(C(=C4)CN5CCCCC5)O)CN6CCCCC6

InChI

InChI=1S/C36H54N4O4S/c41-35-29(25-37-13-5-1-6-14-37)21-33(22-30(35)26-38-15-7-2-8-16-38)45(43,44)34-23-31(27-39-17-9-3-10-18-39)36(42)32(24-34)28-40-19-11-4-12-20-40/h21-24,41-42H,1-20,25-28H2