tert-butyl 1-[2-(cyclohexylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[2-(cyclohexylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[2-(cyclohexylamino)-1-hydroxy-2-oxo-ethyl]pyrrolidin-1-ium-1-carboxylate CAS Name: 1-[2-(cyclohexylamino)-1-hydroxy-2-oxoethyl]-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-(cyclohexylamino)-1-hydroxy-2-oxoethyl]pyrrolidin-1-ium-1-carboxylate Traditional Name: 1-[2-(cyclohexylamino)-1-hydroxy-2-keto-ethyl]pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C17H31N2O4+ MolecularWeight: 327.43904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCC2)O

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCC2)O

InChI

InChI=1S/C17H30N2O4/c1-17(2,3)23-16(22)19(11-7-8-12-19)15(21)14(20)18-13-9-5-4-6-10-13/h13,15,21H,4-12H2,1-3H3/p+1