tert-butyl (2S,3R)-4-cyclohexyl-2-methyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]butanoate

Systemtic Name: tert-butyl (2S,3R)-4-cyclohexyl-2-methyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]butanoate Openeye Name: tert-butyl (2S,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4-cyclohexyl-2-methyl-butanoate CAS Name: (2S,3R)-4-cyclohexyl-2-methyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4-cyclohexyl-2-methylbutanoate Traditional Name: (2S,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4-cyclohexyl-2-methyl-butyric acid tert-butyl ester Formula: C30H43NO2 MolecularWeight: 449.66792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(CC3CCCCC3)C(C)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)[C@H](CC3CCCCC3)[C@H](C)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H43NO2/c1-23(29(32)33-30(3,4)5)28(21-25-15-9-6-10-16-25)31(22-26-17-11-7-12-18-26)24(2)27-19-13-8-14-20-27/h7-8,11-14,17-20,23-25,28H,6,9-10,15-16,21-22H2,1-5H3/t23-,24+,28+/m0/s1