10-hexadecyl-10-aza-1,4,7-triazoniacyclododecane-2,6-dione

Systemtic Name: 10-hexadecyl-10-aza-1,4,7-triazoniacyclododecane-2,6-dione Openeye Name: 10-hexadecyl-10-aza-1,4,7-triazoniacyclododecane-2,6-dione CAS Name: 10-hexadecyl-10-aza-1,4,7-triazoniacyclododecane-2,6-dione IUPAC Name: 10-hexadecyl-10-aza-1,4,7-triazoniacyclododecane-2,6-dione Traditional Name: 10-cetyl-10-aza-1,4,7-triazoniacyclododecane-2,6-quinone Formula: C24H51N4O2+3 MolecularWeight: 427.68734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1CC[NH2+]C(=O)C[NH2+]CC(=O)[NH2+]CC1

Isomeric SMILES

CCCCCCCCCCCCCCCCN1CC[NH2+]C(=O)C[NH2+]CC(=O)[NH2+]CC1

InChI

InChI=1S/C24H48N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-28-19-16-26-23(29)21-25-22-24(30)27-17-20-28/h25H,2-22H2,1H3,(H,26,29)(H,27,30)/p+3