1-[2-(3-azanylpropylamino)-2-oxidanylidene-ethyl]-1-butyl-pyrrolidin-1-ium-3-carboxylic acid

Systemtic Name: 1-[2-(3-azanylpropylamino)-2-oxidanylidene-ethyl]-1-butyl-pyrrolidin-1-ium-3-carboxylic acid Openeye Name: 1-[2-(3-aminopropylamino)-2-oxo-ethyl]-1-butyl-pyrrolidin-1-ium-3-carboxylic acid CAS Name: 1-[2-(3-aminopropylamino)-2-oxoethyl]-1-butyl-3-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-[2-(3-aminopropylamino)-2-oxoethyl]-1-butylpyrrolidin-1-ium-3-carboxylic acid Traditional Name: 1-[2-(3-aminopropylamino)-2-keto-ethyl]-1-butyl-pyrrolidin-1-ium-3-carboxylic acid Formula: C14H28N3O3+ MolecularWeight: 286.39042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCC(C1)C(=O)O)CC(=O)NCCCN

Isomeric SMILES

CCCC[N+]1(CCC(C1)C(=O)O)CC(=O)NCCCN

InChI

InChI=1S/C14H27N3O3/c1-2-3-8-17(9-5-12(10-17)14(19)20)11-13(18)16-7-4-6-15/h12H,2-11,15H2,1H3,(H-,16,18,19,20)/p+1