2-[4-(4-hexylphenyl)carbonylphenyl]carbonyloxyethyl-trimethyl-azanium

Systemtic Name: 2-[4-(4-hexylphenyl)carbonylphenyl]carbonyloxyethyl-trimethyl-azanium Openeye Name: 2-[4-(4-hexylbenzoyl)benzoyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[4-[(4-hexylphenyl)-oxomethyl]phenyl]-oxomethoxy]ethyl-trimethylammonium IUPAC Name: 2-[4-(4-hexylbenzoyl)benzoyl]oxyethyl-trimethylazanium Traditional Name: 2-[4-(4-hexylbenzoyl)benzoyl]oxyethyl-trimethyl-ammonium Formula: C25H34NO3+ MolecularWeight: 396.54236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCC[N+](C)(C)C

InChI

InChI=1S/C25H34NO3/c1-5-6-7-8-9-20-10-12-21(13-11-20)24(27)22-14-16-23(17-15-22)25(28)29-19-18-26(2,3)4/h10-17H,5-9,18-19H2,1-4H3/q+1