1-[(1-hexylpiperazin-1-ium-1-yl)methyl]-4-[3-[4-[(1-hexylpiperazin-1-ium-1-yl)methyl]-3,5-bis(oxidanylidene)piperazin-1-yl]butan-2-yl]piperazine-2,6-dione

Systemtic Name: 1-[(1-hexylpiperazin-1-ium-1-yl)methyl]-4-[3-[4-[(1-hexylpiperazin-1-ium-1-yl)methyl]-3,5-bis(oxidanylidene)piperazin-1-yl]butan-2-yl]piperazine-2,6-dione Openeye Name: 1-[(1-hexylpiperazin-1-ium-1-yl)methyl]-4-[2-[4-[(1-hexylpiperazin-1-ium-1-yl)methyl]-3,5-dioxo-piperazin-1-yl]-1-methyl-propyl]piperazine-2,6-dione CAS Name: 1-[(1-hexyl-1-piperazin-1-iumyl)methyl]-4-[3-[4-[(1-hexyl-1-piperazin-1-iumyl)methyl]-3,5-dioxo-1-piperazinyl]butan-2-yl]piperazine-2,6-dione IUPAC Name: 1-[(1-hexylpiperazin-1-ium-1-yl)methyl]-4-[3-[4-[(1-hexylpiperazin-1-ium-1-yl)methyl]-3,5-dioxopiperazin-1-yl]butan-2-yl]piperazine-2,6-dione Traditional Name: 1-[(1-hexylpiperazin-1-ium-1-yl)methyl]-4-[2-[4-[(1-hexylpiperazin-1-ium-1-yl)methyl]-3,5-diketo-piperazino]-1-methyl-propyl]piperazine-2,6-quinone Formula: C34H64N8O4+2 MolecularWeight: 648.92316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1(CCNCC1)CN2C(=O)CN(CC2=O)C(C)C(C)N3CC(=O)N(C(=O)C3)C[N+]4(CCNCC4)CCCCCC

Isomeric SMILES

CCCCCC[N+]1(CCNCC1)CN2C(=O)CN(CC2=O)C(C)C(C)N3CC(=O)N(C(=O)C3)C[N+]4(CCNCC4)CCCCCC

InChI

InChI=1S/C34H64N8O4/c1-5-7-9-11-17-41(19-13-35-14-20-41)27-39-31(43)23-37(24-32(39)44)29(3)30(4)38-25-33(45)40(34(46)26-38)28-42(18-12-10-8-6-2)21-15-36-16-22-42/h29-30,35-36H,5-28H2,1-4H3/q+2