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

Systemtic Name: tert-butyl 1-[2-(cycloheptylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[2-(cycloheptylamino)-1-hydroxy-2-oxo-ethyl]pyrrolidin-1-ium-1-carboxylate CAS Name: 1-[2-(cycloheptylamino)-1-hydroxy-2-oxoethyl]-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-(cycloheptylamino)-1-hydroxy-2-oxoethyl]pyrrolidin-1-ium-1-carboxylate Traditional Name: 1-[2-(cycloheptylamino)-1-hydroxy-2-keto-ethyl]pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C18H33N2O4+ MolecularWeight: 341.46562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCCC2)O

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCCC2)O

InChI

InChI=1S/C18H32N2O4/c1-18(2,3)24-17(23)20(12-8-9-13-20)16(22)15(21)19-14-10-6-4-5-7-11-14/h14,16,22H,4-13H2,1-3H3/p+1