2-hydroxyethyl(2-methyltridecan-2-yl)azanium; 2-oxidanyl-2,2-diphenyl-ethanoate; bromide

Systemtic Name: 2-hydroxyethyl(2-methyltridecan-2-yl)azanium; 2-oxidanyl-2,2-diphenyl-ethanoate; bromide Openeye Name: 1,1-dimethyldodecyl(2-hydroxyethyl)ammonium; 2-hydroxy-2,2-diphenyl-acetate; bromide CAS Name: 2-hydroxy-2,2-diphenylacetate; 2-hydroxyethyl(2-methyltridecan-2-yl)ammonium; bromide IUPAC Name: 2-hydroxy-2,2-diphenylacetate; 2-hydroxyethyl(2-methyltridecan-2-yl)azanium; bromide Traditional Name: benzilate; 1,1-dimethyldodecyl(2-hydroxyethyl)ammonium; bromide Formula: C30H47BrNO4- MolecularWeight: 565.60248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)(C)[NH2+]CCO.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)[O-])O.[Br-]

Isomeric SMILES

CCCCCCCCCCCC(C)(C)[NH2+]CCO.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)[O-])O.[Br-]

InChI

InChI=1S/C16H35NO.C14H12O3.BrH/c1-4-5-6-7-8-9-10-11-12-13-16(2,3)17-14-15-18;15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h17-18H,4-15H2,1-3H3;1-10,17H,(H,15,16);1H/p-1