1-(2,2-dimethyl-3-sulfanyl-propanoyl)-1-methyl-pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-(2,2-dimethyl-3-sulfanyl-propanoyl)-1-methyl-pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-(2,2-dimethyl-3-sulfanyl-propanoyl)-1-methyl-pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-(3-mercapto-2,2-dimethyl-1-oxopropyl)-1-methyl-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-(2,2-dimethyl-3-sulfanylpropanoyl)-1-methylpyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-(3-mercapto-2,2-dimethyl-propanoyl)-1-methyl-pyrrolidin-1-ium-2-carboxylic acid Formula: C11H20NO3S+ MolecularWeight: 246.3464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19NO3S/c1-11(2,7-16)10(15)12(3)6-4-5-8(12)9(13)14/h8H,4-7H2,1-3H3,(H-,13,14,16)/p+1