tert-butyl N-[(2S)-3-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-methyl-1-[[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]methyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-[(2S)-2-[oxo-(4-phenylbutylamino)methyl]-1-pyrrolidinyl]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidino]methyl]propyl]carbamic acid tert-butyl ester Formula: C25H41N3O3 MolecularWeight: 431.61134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1CCCC1C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](CN1CCC[C@H]1C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H41N3O3/c1-19(2)21(27-24(30)31-25(3,4)5)18-28-17-11-15-22(28)23(29)26-16-10-9-14-20-12-7-6-8-13-20/h6-8,12-13,19,21-22H,9-11,14-18H2,1-5H3,(H,26,29)(H,27,30)/t21-,22+/m1/s1