2-[dimethyl-[3-(octanoylamino)propyl]azaniumyl]ethanoate

Systemtic Name: 2-[dimethyl-[3-(octanoylamino)propyl]azaniumyl]ethanoate Openeye Name: 2-[dimethyl-[3-(octanoylamino)propyl]ammonio]acetate CAS Name: 2-[dimethyl-[3-(1-oxooctylamino)propyl]ammonio]acetate IUPAC Name: 2-[dimethyl-[3-(octanoylamino)propyl]azaniumyl]acetate Traditional Name: 2-[3-(caprylylamino)propyl-dimethyl-ammonio]acetate Formula: C15H30N2O3 MolecularWeight: 286.4103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C15H30N2O3/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)