1,5-bis[4-(phenylmethyl)piperazin-1-yl]pentane-1,5-dione

Systemtic Name: 1,5-bis[4-(phenylmethyl)piperazin-1-yl]pentane-1,5-dione Openeye Name: 1,5-bis(4-benzylpiperazin-1-yl)pentane-1,5-dione CAS Name: 1,5-bis[4-(phenylmethyl)-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1,5-bis(4-benzylpiperazin-1-yl)pentane-1,5-dione Traditional Name: 1,5-bis(4-benzylpiperazino)pentane-1,5-dione Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O2/c32-26(30-18-14-28(15-19-30)22-24-8-3-1-4-9-24)12-7-13-27(33)31-20-16-29(17-21-31)23-25-10-5-2-6-11-25/h1-6,8-11H,7,12-23H2