tert-butyl (2S)-2-[3-[4-(3-azanylpropylamino)butylamino]propylcarbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[3-[4-(3-azanylpropylamino)butylamino]propylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[3-[4-(3-aminopropylamino)butylamino]propylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H41N5O3 MolecularWeight: 399.57124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NCCCNCCCCNCCCN

Isomeric SMILES

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

InChI

InChI=1S/C20H41N5O3/c1-20(2,3)28-19(27)25-16-6-9-17(25)18(26)24-15-8-14-23-12-5-4-11-22-13-7-10-21/h17,22-23H,4-16,21H2,1-3H3,(H,24,26)/t17-/m0/s1