tert-butyl N-[1-[1-[2-(cyclopropylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[1-[2-(cyclopropylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[1-[2-(cyclopropylamino)-1-hydroxy-2-oxo-ethyl]pyrrolidin-1-ium-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[1-[2-(cyclopropylamino)-1-hydroxy-2-oxoethyl]-1-pyrrolidin-1-iumyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[1-[2-(cyclopropylamino)-1-hydroxy-2-oxoethyl]pyrrolidin-1-ium-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[1-[2-(cyclopropylamino)-1-hydroxy-2-keto-ethyl]pyrrolidin-1-ium-1-yl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C23H34N3O5+ MolecularWeight: 432.53316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)[N+]2(CCCC2)C(C(=O)NC3CC3)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)[N+]2(CCCC2)C(C(=O)NC3CC3)O

InChI

InChI=1S/C23H33N3O5/c1-23(2,3)31-22(30)25-18(15-16-9-5-4-6-10-16)20(28)26(13-7-8-14-26)21(29)19(27)24-17-11-12-17/h4-6,9-10,17-18,21,29H,7-8,11-15H2,1-3H3,(H-,24,25,27,30)/p+1