6-[(3-cyano-2-oxidanyl-propyl)-phenylmethoxycarbonyl-amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid

Systemtic Name: 6-[(3-cyano-2-oxidanyl-propyl)-phenylmethoxycarbonyl-amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Openeye Name: 6-[benzyloxycarbonyl-(3-cyano-2-hydroxy-propyl)amino]-2-(tert-butoxycarbonylamino)hexanoic acid CAS Name: 6-[(3-cyano-2-hydroxypropyl)-phenylmethoxycarbonylamino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(3-cyano-2-hydroxypropyl)-phenylmethoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-6-[carbobenzoxy-(3-cyano-2-hydroxy-propyl)amino]hexanoic acid Formula: C23H33N3O7 MolecularWeight: 463.52402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCN(CC(CC#N)O)C(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCCN(CC(CC#N)O)C(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C23H33N3O7/c1-23(2,3)33-21(30)25-19(20(28)29)11-7-8-14-26(15-18(27)12-13-24)22(31)32-16-17-9-5-4-6-10-17/h4-6,9-10,18-19,27H,7-8,11-12,14-16H2,1-3H3,(H,25,30)(H,28,29)