[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate CAS Name: (2R)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-phenylpropanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoate Traditional Name: (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propionic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C34H39NO4 MolecularWeight: 525.67776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(C)C

InChI

InChI=1S/C34H39NO4/c1-22(2)25-18-17-23(3)19-32(25)39-33(36)31(20-24-11-5-4-6-12-24)35-34(37)38-21-30-28-15-9-7-13-26(28)27-14-8-10-16-29(27)30/h4-16,22-23,25,30-32H,17-21H2,1-3H3,(H,35,37)/t23-,25+,31-,32-/m1/s1