tert-butyl N-[(1R,2R,6S)-4-cyano-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-pentan-3-yloxy-cyclohex-3-en-1-yl]carbamate

Systemtic Name: tert-butyl N-[(1R,2R,6S)-4-cyano-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-pentan-3-yloxy-cyclohex-3-en-1-yl]carbamate Openeye Name: tert-butyl N-[(1R,2R,6S)-6-(tert-butoxycarbonylamino)-4-cyano-2-(1-ethylpropoxy)cyclohex-3-en-1-yl]carbamate CAS Name: N-[(1R,2R,6S)-4-cyano-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pentan-3-yloxy-1-cyclohex-3-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,2R,6S)-4-cyano-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-pentan-3-yloxycyclohex-3-en-1-yl]carbamate Traditional Name: N-[(1R,2R,6S)-6-(tert-butoxycarbonylamino)-4-cyano-2-(1-ethylpropoxy)cyclohex-3-en-1-yl]carbamic acid tert-butyl ester Formula: C22H37N3O5 MolecularWeight: 423.54628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC(C1NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C#N

Isomeric SMILES

CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C22H37N3O5/c1-9-15(10-2)28-17-12-14(13-23)11-16(24-19(26)29-21(3,4)5)18(17)25-20(27)30-22(6,7)8/h12,15-18H,9-11H2,1-8H3,(H,24,26)(H,25,27)/t16-,17+,18+/m0/s1