1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium

Systemtic Name: 1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium Openeye Name: 1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium CAS Name: 1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium IUPAC Name: 1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium Traditional Name: 1-cyclononyl-1-[2-(1-cyclononyl-1,4,7-triazonan-1-ium-1-yl)ethyl]-1,4,7-triazonan-1-ium Formula: C32H66N6+2 MolecularWeight: 534.90664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCC1)[N+]2(CCNCCNCC2)CC[N+]3(CCNCCNCC3)C4CCCCCCCC4

Isomeric SMILES

C1CCCCC(CCC1)[N+]2(CCNCCNCC2)CC[N+]3(CCNCCNCC3)C4CCCCCCCC4

InChI

InChI=1S/C32H66N6/c1-2-6-10-14-31(13-9-5-1)37(25-21-33-17-18-34-22-26-37)29-30-38(27-23-35-19-20-36-24-28-38)32-15-11-7-3-4-8-12-16-32/h31-36H,1-30H2/q+2