tert-butyl (2S)-2-[[1-(phenylmethoxycarbonylamino)cyclohexyl]carbonylamino]-2-pyridin-2-yl-ethanoate

Systemtic Name: tert-butyl (2S)-2-[[1-(phenylmethoxycarbonylamino)cyclohexyl]carbonylamino]-2-pyridin-2-yl-ethanoate Openeye Name: tert-butyl (2S)-2-[[1-(benzyloxycarbonylamino)cyclohexanecarbonyl]amino]-2-(2-pyridyl)acetate CAS Name: (2S)-2-[[oxo-[1-(phenylmethoxycarbonylamino)cyclohexyl]methyl]amino]-2-(2-pyridinyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[1-(phenylmethoxycarbonylamino)cyclohexanecarbonyl]amino]-2-pyridin-2-ylacetate Traditional Name: (2S)-2-[[1-(benzyloxycarbonylamino)cyclohexanecarbonyl]amino]-2-(2-pyridyl)acetic acid tert-butyl ester Formula: C26H33N3O5 MolecularWeight: 467.55732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=CC=N1)NC(=O)C2(CCCCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](C1=CC=CC=N1)NC(=O)C2(CCCCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H33N3O5/c1-25(2,3)34-22(30)21(20-14-8-11-17-27-20)28-23(31)26(15-9-5-10-16-26)29-24(32)33-18-19-12-6-4-7-13-19/h4,6-8,11-14,17,21H,5,9-10,15-16,18H2,1-3H3,(H,28,31)(H,29,32)/t21-/m0/s1