1,6-bis(4-butoxyphenyl)-2,5-bis(piperidin-1-ylmethyl)hexane-1,6-dione dihydrochloride

Systemtic Name: 1,6-bis(4-butoxyphenyl)-2,5-bis(piperidin-1-ylmethyl)hexane-1,6-dione dihydrochloride Openeye Name: 1,6-bis(4-butoxyphenyl)-2,5-bis(1-piperidylmethyl)hexane-1,6-dione dihydrochloride CAS Name: 1,6-bis(4-butoxyphenyl)-2,5-bis(1-piperidinylmethyl)hexane-1,6-dione dihydrochloride IUPAC Name: 1,6-bis(4-butoxyphenyl)-2,5-bis(piperidin-1-ylmethyl)hexane-1,6-dione dihydrochloride Traditional Name: 1,6-bis(4-butoxyphenyl)-2,5-bis(piperidinomethyl)hexane-1,6-dione dihydrochloride Formula: C38H58Cl2N2O4 MolecularWeight: 677.78412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C(CCC(CN2CCCCC2)C(=O)C3=CC=C(C=C3)OCCCC)CN4CCCCC4.Cl.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)C(CCC(CN2CCCCC2)C(=O)C3=CC=C(C=C3)OCCCC)CN4CCCCC4.Cl.Cl

InChI

InChI=1S/C38H56N2O4.2ClH/c1-3-5-27-43-35-19-15-31(16-20-35)37(41)33(29-39-23-9-7-10-24-39)13-14-34(30-40-25-11-8-12-26-40)38(42)32-17-21-36(22-18-32)44-28-6-4-2;;/h15-22,33-34H,3-14,23-30H2,1-2H3;2*1H