tert-butyl (2S)-1-[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S)-1-[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S)-1-[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-3-methyl-1-oxo-2-[[oxo(phenoxy)methyl]amino]butyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-1-[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(carbophenoxyamino)-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C)NC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O5/c1-14(2)17(22-20(26)27-15-10-7-6-8-11-15)18(24)23-13-9-12-16(23)19(25)28-21(3,4)5/h6-8,10-11,14,16-17H,9,12-13H2,1-5H3,(H,22,26)/t16-,17-/m0/s1