(2S,4R,5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-6-phenyl-2-[(E)-2-phenylethenyl]hexanoic acid

Systemtic Name: (2S,4R,5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-6-phenyl-2-[(E)-2-phenylethenyl]hexanoic acid Openeye Name: (2S,4R,5S)-5-(tert-butoxycarbonylamino)-4-hydroxy-6-phenyl-2-[(E)-styryl]hexanoic acid CAS Name: (2S,4R,5S)-4-hydroxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-phenyl-2-[(E)-2-phenylethenyl]hexanoic acid IUPAC Name: (2S,4R,5S)-4-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenyl-2-[(E)-2-phenylethenyl]hexanoic acid Traditional Name: (E,2S)-2-[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-4-phenyl-but-3-enoic acid Formula: C25H31NO5 MolecularWeight: 425.51734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CC(C=CC2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](C[C@@H](/C=C/C2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C25H31NO5/c1-25(2,3)31-24(30)26-21(16-19-12-8-5-9-13-19)22(27)17-20(23(28)29)15-14-18-10-6-4-7-11-18/h4-15,20-22,27H,16-17H2,1-3H3,(H,26,30)(H,28,29)/b15-14+/t20-,21+,22-/m1/s1