1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-1-[(3-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)amino]pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-1-[(3-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)amino]pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-[(1-carboxy-2-methyl-butyl)amino]-1-(3,3-dimethyl-2-oxo-pentanoyl)pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-(3,3-dimethyl-1,2-dioxopentyl)-1-[(1-hydroxy-3-methyl-1-oxopentan-2-yl)amino]-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-(3,3-dimethyl-2-oxopentanoyl)-1-[(1-hydroxy-3-methyl-1-oxopentan-2-yl)amino]pyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-[(1-carboxy-2-methyl-butyl)amino]-1-(2-keto-3,3-dimethyl-pentanoyl)pyrrolidin-1-ium-2-carboxylic acid Formula: C18H31N2O6+ MolecularWeight: 371.44854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N[N+]1(CCCC1C(=O)O)C(=O)C(=O)C(C)(C)CC

Isomeric SMILES

CCC(C)C(C(=O)O)N[N+]1(CCCC1C(=O)O)C(=O)C(=O)C(C)(C)CC

InChI

InChI=1S/C18H30N2O6/c1-6-11(3)13(17(25)26)19-20(10-8-9-12(20)16(23)24)15(22)14(21)18(4,5)7-2/h11-13,19H,6-10H2,1-5H3,(H-,23,24,25,26)/p+1