2,4-bis(azepan-1-yl)-1,5-diphenyl-pentane-1,5-dione dihydrochloride

Systemtic Name: 2,4-bis(azepan-1-yl)-1,5-diphenyl-pentane-1,5-dione dihydrochloride Openeye Name: 2,4-bis(azepan-1-yl)-1,5-diphenyl-pentane-1,5-dione dihydrochloride CAS Name: 2,4-bis(1-azepanyl)-1,5-diphenylpentane-1,5-dione dihydrochloride IUPAC Name: 2,4-bis(azepan-1-yl)-1,5-diphenylpentane-1,5-dione dihydrochloride Traditional Name: 2,4-bis(azepan-1-yl)-1,5-diphenyl-pentane-1,5-dione dihydrochloride Formula: C29H40Cl2N2O2 MolecularWeight: 519.5461

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CC(C(=O)C2=CC=CC=C2)N3CCCCCC3)C(=O)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

C1CCCN(CC1)C(CC(C(=O)C2=CC=CC=C2)N3CCCCCC3)C(=O)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C29H38N2O2.2ClH/c32-28(24-15-7-5-8-16-24)26(30-19-11-1-2-12-20-30)23-27(31-21-13-3-4-14-22-31)29(33)25-17-9-6-10-18-25;;/h5-10,15-18,26-27H,1-4,11-14,19-23H2;2*1H