2-(dimethylamino)-2-(dodecanoylamino)pentanoic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-(dimethylamino)-2-(dodecanoylamino)pentanoic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-(dimethylamino)-2-(dodecanoylamino)pentanoic acid; 2-(trimethylammonio)acetate CAS Name: 2-(dimethylamino)-2-(1-oxododecylamino)pentanoic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-(dimethylamino)-2-(dodecanoylamino)pentanoic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-(dimethylamino)-2-(lauroylamino)valeric acid; 2-(trimethylammonio)acetate Formula: C24H49N3O5 MolecularWeight: 459.66296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CCC)(C(=O)O)N(C)C.C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(CCC)(C(=O)O)N(C)C.C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C19H38N2O3.C5H11NO2/c1-5-7-8-9-10-11-12-13-14-15-17(22)20-19(16-6-2,18(23)24)21(3)4;1-6(2,3)4-5(7)8/h5-16H2,1-4H3,(H,20,22)(H,23,24);4H2,1-3H3