bis(2-hydroxyethyl)-pentadecyl-(phenylmethyl)azanium chloride

Systemtic Name: bis(2-hydroxyethyl)-pentadecyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-bis(2-hydroxyethyl)-pentadecyl-ammonium chloride CAS Name: bis(2-hydroxyethyl)-pentadecyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-bis(2-hydroxyethyl)-pentadecylazanium chloride Traditional Name: benzyl-bis(2-hydroxyethyl)-pentadecyl-ammonium chloride Formula: C26H48ClNO2 MolecularWeight: 442.11782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C26H48NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-27(21-23-28,22-24-29)25-26-18-15-14-16-19-26;/h14-16,18-19,28-29H,2-13,17,20-25H2,1H3;1H/q+1;/p-1