tert-butyl (2S)-2-[[(5S)-5-azanyl-6-methoxy-6-oxidanylidene-hexyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(5S)-5-azanyl-6-methoxy-6-oxidanylidene-hexyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(5S)-5-amino-6-methoxy-6-oxo-hexyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(5S)-5-amino-6-methoxy-6-oxohexyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(5S)-5-amino-6-methoxy-6-oxohexyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(5S)-5-amino-6-keto-6-methoxy-hexyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H31N3O5 MolecularWeight: 357.44514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NCCCCC(C(=O)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCC[C@@H](C(=O)OC)N

InChI

InChI=1S/C17H31N3O5/c1-17(2,3)25-16(23)20-11-7-9-13(20)14(21)19-10-6-5-8-12(18)15(22)24-4/h12-13H,5-11,18H2,1-4H3,(H,19,21)/t12-,13-/m0/s1