(27-azaniumyl-4,5,5,6,6-pentapropyl-heptacosan-4-yl)azanium

Systemtic Name: (27-azaniumyl-4,5,5,6,6-pentapropyl-heptacosan-4-yl)azanium Openeye Name: (24-azaniumyl-1,1,2,2,3,3-hexapropyl-tetracosyl)ammonium CAS Name: (27-ammonio-4,5,5,6,6-pentapropylheptacosan-4-yl)ammonium IUPAC Name: (27-azaniumyl-4,5,5,6,6-pentapropylheptacosan-4-yl)azanium Traditional Name: (24-ammonio-1,1,2,2,3,3-hexapropyl-tetracosyl)ammonium Formula: C42H90N2+2 MolecularWeight: 623.1774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(CCCCCCCCCCCCCCCCCCCCC[NH3+])C(CCC)(CCC)C(CCC)(CCC)[NH3+]

Isomeric SMILES

CCCC(CCC)(CCCCCCCCCCCCCCCCCCCCC[NH3+])C(CCC)(CCC)C(CCC)(CCC)[NH3+]

InChI

InChI=1S/C42H88N2/c1-7-32-40(33-8-2,41(34-9-3,35-10-4)42(44,36-11-5)37-12-6)38-30-28-26-24-22-20-18-16-14-13-15-17-19-21-23-25-27-29-31-39-43/h7-39,43-44H2,1-6H3/p+2