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Reference substances

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IUPAC name:
N-(carboxymethyl)-N,N-dimethyl-3-(octanoylamino)propan-1-aminium hydroxide

Inventory

EC number:
277-600-6
EC name:
(carboxymethyl)dimethyl-3-[(1-oxooctyl)amino]propylammonium hydroxide
CAS number:
73772-46-0
CAS number:
73772-46-0
Synonyms
Names:
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-[(1-oxooctyl)amino]-, inner salt
Identifier:
CAS number
73772-46-0
Identifier:
EC name
(carboxymethyl)dimethyl-3-[(1-oxooctyl)amino]propylammonium hydroxide
Identifier:
EC number
277-600-6
Identifier:
IUPAC name
N-(carboxymethyl)-3-(decanoylamino)-N,N-dimethylpropan-1-aminium hydroxide
Identifier:
IUPAC name
N-(carboxymethyl)-N,N-dimethyl-3-(octanoylamino)propan-1-aminium hydroxide
Identifier:
other: Molecular formula
C15H32N2O4
Identifier:
other: InChl
InChI=1S/C17H34N2O3.H2O/c1-4-5-6-7-8-9-10-12-16(20)18-13-11-14-19(2,3)15-17(21)22;/h4-15H2,1-3H3,(H-,18,20,21,22);1H2
Identifier:
other: SMILES notation
O=C(NCCC[N+](C)(C)CC(O)=O)CCCCCCCCC.[OH-]

Molecular and structural information

Molecular formula:
C15H30N2O3
Molecular weight:
304.43
SMILES notation:
[OH-].CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)O
InChl:
InChI=1/C15H30N2O3.H2O/c1-4-5-6-7-8-10-14(18)16-11-9-12-17(2,3)13-15(19)20;/h4-13H2,1-3H3,(H-,16,18,19,20);1H2
Structural formula:
Chemical structure

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