2-hydroxyethyl(tripentyl)azanium benzoate chloride

Systemtic Name: 2-hydroxyethyl(tripentyl)azanium benzoate chloride Openeye Name: 2-hydroxyethyl(tripentyl)ammonium benzoate chloride CAS Name: 2-hydroxyethyl(tripentyl)ammonium benzoate chloride IUPAC Name: 2-hydroxyethyl(tripentyl)azanium benzoate chloride Traditional Name: triamyl(2-hydroxyethyl)ammonium benzoate chloride Formula: C24H43ClNO3- MolecularWeight: 429.05612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCCC)(CCCCC)CCO.C1=CC=C(C=C1)C(=O)[O-].[Cl-]

Isomeric SMILES

CCCCC[N+](CCCCC)(CCCCC)CCO.C1=CC=C(C=C1)C(=O)[O-].[Cl-]

InChI

InChI=1S/C17H38NO.C7H6O2.ClH/c1-4-7-10-13-18(16-17-19,14-11-8-5-2)15-12-9-6-3;8-7(9)6-4-2-1-3-5-6;/h19H,4-17H2,1-3H3;1-5H,(H,8,9);1H/q+1;;/p-2