tert-butyl N-[(3S)-1-piperidin-1-ium-4-ylpyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S)-1-piperidin-1-ium-4-ylpyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[(3S)-1-piperidin-1-ium-4-ylpyrrolidin-3-yl]carbamate CAS Name: N-[(3S)-1-(4-piperidin-1-iumyl)-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-1-piperidin-1-ium-4-ylpyrrolidin-3-yl]carbamate Traditional Name: N-[(3S)-1-piperidin-1-ium-4-ylpyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C14H28N3O2+ MolecularWeight: 270.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)C2CC[NH2+]CC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]1CCN(C1)C2CC[NH2+]CC2

InChI

InChI=1S/C14H27N3O2/c1-14(2,3)19-13(18)16-11-6-9-17(10-11)12-4-7-15-8-5-12/h11-12,15H,4-10H2,1-3H3,(H,16,18)/p+1/t11-/m0/s1