2-dodecoxyethyl-bis(2-hydroxyethyl)-(phenylmethyl)azanium

Systemtic Name: 2-dodecoxyethyl-bis(2-hydroxyethyl)-(phenylmethyl)azanium Openeye Name: benzyl-(2-dodecoxyethyl)-bis(2-hydroxyethyl)ammonium CAS Name: 2-dodecoxyethyl-bis(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-dodecoxyethyl)-bis(2-hydroxyethyl)azanium Traditional Name: benzyl-bis(2-hydroxyethyl)-(2-lauryloxyethyl)ammonium Formula: C25H46NO3+ MolecularWeight: 408.63764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC[N+](CCO)(CCO)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCOCC[N+](CCO)(CCO)CC1=CC=CC=C1

InChI

InChI=1S/C25H46NO3/c1-2-3-4-5-6-7-8-9-10-14-22-29-23-19-26(17-20-27,18-21-28)24-25-15-12-11-13-16-25/h11-13,15-16,27-28H,2-10,14,17-24H2,1H3/q+1