[5-[12-[(6-azaniumyl-2-azanyl-hexanoyl)amino]dodecanoylamino]-6-oxidanyl-6-oxidanylidene-hexyl]azanium

Systemtic Name: [5-[12-[(6-azaniumyl-2-azanyl-hexanoyl)amino]dodecanoylamino]-6-oxidanyl-6-oxidanylidene-hexyl]azanium Openeye Name: [5-amino-6-[[12-[(5-azaniumyl-1-carboxy-pentyl)amino]-12-oxo-dodecyl]amino]-6-oxo-hexyl]ammonium CAS Name: [5-amino-6-[[12-[(6-ammonio-1-hydroxy-1-oxohexan-2-yl)amino]-12-oxododecyl]amino]-6-oxohexyl]ammonium IUPAC Name: [5-[12-[(2-amino-6-azaniumylhexanoyl)amino]dodecanoylamino]-6-hydroxy-6-oxohexyl]azanium Traditional Name: [5-amino-6-[[12-[(5-ammonio-1-carboxy-pentyl)amino]-12-keto-dodecyl]amino]-6-keto-hexyl]ammonium Formula: C24H51N5O4+2 MolecularWeight: 473.69284

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCC(=O)NC(CCCC[NH3+])C(=O)O)CCCCCNC(=O)C(CCCC[NH3+])N

Isomeric SMILES

C(CCCCCC(=O)NC(CCCC[NH3+])C(=O)O)CCCCCNC(=O)C(CCCC[NH3+])N

InChI

InChI=1S/C24H49N5O4/c25-17-11-9-14-20(27)23(31)28-19-13-7-5-3-1-2-4-6-8-16-22(30)29-21(24(32)33)15-10-12-18-26/h20-21H,1-19,25-27H2,(H,28,31)(H,29,30)(H,32,33)/p+2