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1,8-bis(4-ethoxyphenyl)-2,7-bis(piperidin-1-ylmethyl)octane-1,8-dione dihydrochloride

1,8-bis(4-ethoxyphenyl)-2,7-bis(piperidin-1-ylmethyl)octane-1,8-dione dihydrochloride

Systemtic Name:1,8-bis(4-ethoxyphenyl)-2,7-bis(piperidin-1-ylmethyl)octane-1,8-dione dihydrochloride
Openeye Name:1,8-bis(4-ethoxyphenyl)-2,7-bis(1-piperidylmethyl)octane-1,8-dione dihydrochloride
CAS Name:1,8-bis(4-ethoxyphenyl)-2,7-bis(1-piperidinylmethyl)octane-1,8-dione dihydrochloride
IUPAC Name:1,8-bis(4-ethoxyphenyl)-2,7-bis(piperidin-1-ylmethyl)octane-1,8-dione dihydrochloride
Traditional Name:2,7-bis(piperidinomethyl)-1,8-bis(p-phenetyl)octane-1,8-dione dihydrochloride
Formula: C36H54Cl2N2O4
MolecularWeight: 649.73096
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(CCCCC(CN2CCCCC2)C(=O)C3=CC=C(C=C3)OCC)CN4CCCCC4.Cl.Cl


Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C(CCCCC(CN2CCCCC2)C(=O)C3=CC=C(C=C3)OCC)CN4CCCCC4.Cl.Cl


InChI

InChI=1S/C36H52N2O4.2ClH/c1-3-41-33-19-15-29(16-20-33)35(39)31(27-37-23-9-5-10-24-37)13-7-8-14-32(28-38-25-11-6-12-26-38)36(40)30-17-21-34(22-18-30)42-4-2;;/h15-22,31-32H,3-14,23-28H2,1-2H3;2*1H


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