tert-butyl (2S)-6-(3-cyanopropylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Systemtic Name: tert-butyl (2S)-6-(3-cyanopropylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Openeye Name: tert-butyl (2S)-2-(tert-butoxycarbonylamino)-6-(3-cyanopropylamino)hexanoate CAS Name: (2S)-6-(3-cyanopropylamino)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-6-(3-cyanopropylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-6-(3-cyanopropylamino)hexanoic acid tert-butyl ester Formula: C19H35N3O4 MolecularWeight: 369.4989

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCNCCCC#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCCCNCCCC#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H35N3O4/c1-18(2,3)25-16(23)15(22-17(24)26-19(4,5)6)11-7-9-13-21-14-10-8-12-20/h15,21H,7-11,13-14H2,1-6H3,(H,22,24)/t15-/m0/s1