N-[(2S,3S,5S)-8-cyclohexyl-3-oxidanyl-5-(4-oxidanylidenepentanoylamino)-1-phenyl-octan-2-yl]-4-fluoranyl-2-oxidanyl-benzamide

Systemtic Name: N-[(2S,3S,5S)-8-cyclohexyl-3-oxidanyl-5-(4-oxidanylidenepentanoylamino)-1-phenyl-octan-2-yl]-4-fluoranyl-2-oxidanyl-benzamide Openeye Name: N-[(1S,2S,4S)-1-benzyl-7-cyclohexyl-2-hydroxy-4-(4-oxopentanoylamino)heptyl]-4-fluoro-2-hydroxy-benzamide CAS Name: N-[(2S,3S,5S)-8-cyclohexyl-5-(1,4-dioxopentylamino)-3-hydroxy-1-phenyloctan-2-yl]-4-fluoro-2-hydroxybenzamide IUPAC Name: N-[(2S,3S,5S)-8-cyclohexyl-3-hydroxy-5-(4-oxopentanoylamino)-1-phenyloctan-2-yl]-4-fluoro-2-hydroxybenzamide Traditional Name: N-[(1S,2S,4S)-1-benzyl-7-cyclohexyl-2-hydroxy-4-(4-ketopentanoylamino)heptyl]-4-fluoro-2-hydroxy-benzamide Formula: C32H43FN2O5 MolecularWeight: 554.692623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)NC(CCCC1CCCCC1)CC(C(CC2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)F)O)O

Isomeric SMILES

CC(=O)CCC(=O)N[C@@H](CCCC1CCCCC1)C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)F)O)O

InChI

InChI=1S/C32H43FN2O5/c1-22(36)15-18-31(39)34-26(14-8-13-23-9-4-2-5-10-23)21-30(38)28(19-24-11-6-3-7-12-24)35-32(40)27-17-16-25(33)20-29(27)37/h3,6-7,11-12,16-17,20,23,26,28,30,37-38H,2,4-5,8-10,13-15,18-19,21H2,1H3,(H,34,39)(H,35,40)/t26-,28-,30-/m0/s1