2-[(4-cyanophenyl)methyl]-6-cyclohexyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-hexanoic acid

Systemtic Name: 2-[(4-cyanophenyl)methyl]-6-cyclohexyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-2-[(4-cyanophenyl)methyl]-6-cyclohexyl-4-hydroxy-hexanoic acid CAS Name: 2-[(4-cyanophenyl)methyl]-6-cyclohexyl-4-hydroxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(4-cyanophenyl)methyl]-6-cyclohexyl-4-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-2-(4-cyanobenzyl)-6-cyclohexyl-4-hydroxy-hexanoic acid Formula: C25H36N2O5 MolecularWeight: 444.56374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CC(CC2=CC=C(C=C2)C#N)C(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CC(CC2=CC=C(C=C2)C#N)C(=O)O)O

InChI

InChI=1S/C25H36N2O5/c1-25(2,3)32-24(31)27-21(14-17-7-5-4-6-8-17)22(28)15-20(23(29)30)13-18-9-11-19(16-26)12-10-18/h9-12,17,20-22,28H,4-8,13-15H2,1-3H3,(H,27,31)(H,29,30)