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2-[(4-aminocarbonylphenyl)carbonyl-[2-[methyl(dioctyl)azaniumyl]ethyl]amino]ethyl-methyl-dioctyl-azanium

2-[(4-aminocarbonylphenyl)carbonyl-[2-[methyl(dioctyl)azaniumyl]ethyl]amino]ethyl-methyl-dioctyl-azanium

Systemtic Name:2-[(4-aminocarbonylphenyl)carbonyl-[2-[methyl(dioctyl)azaniumyl]ethyl]amino]ethyl-methyl-dioctyl-azanium
Openeye Name:2-[(4-carbamoylbenzoyl)-[2-[methyl(dioctyl)ammonio]ethyl]amino]ethyl-methyl-dioctyl-ammonium
CAS Name:2-[[(4-carbamoylphenyl)-oxomethyl]-[2-[methyl(dioctyl)ammonio]ethyl]amino]ethyl-methyl-dioctylammonium
IUPAC Name:2-[(4-carbamoylbenzoyl)-[2-[methyl(dioctyl)azaniumyl]ethyl]amino]ethyl-methyl-dioctylazanium
Traditional Name:2-[(4-carbamoylbenzoyl)-[2-[methyl(dioctyl)ammonio]ethyl]amino]ethyl-methyl-dioctyl-ammonium
Formula: C46H88N4O2+2
MolecularWeight: 729.21652
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(CCCCCCCC)CCN(CC[N+](C)(CCCCCCCC)CCCCCCCC)C(=O)C1=CC=C(C=C1)C(=O)N


Isomeric SMILES

CCCCCCCC[N+](C)(CCCCCCCC)CCN(CC[N+](C)(CCCCCCCC)CCCCCCCC)C(=O)C1=CC=C(C=C1)C(=O)N


InChI

InChI=1S/C46H87N4O2/c1-7-11-15-19-23-27-37-49(5,38-28-24-20-16-12-8-2)41-35-48(46(52)44-33-31-43(32-34-44)45(47)51)36-42-50(6,39-29-25-21-17-13-9-3)40-30-26-22-18-14-10-4/h31-34H,7-30,35-42H2,1-6H3,(H-,47,51)/q+1/p+1


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