(phenylmethyl) 1-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: (phenylmethyl) 1-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]cyclohexane-1-carboxylate Openeye Name: benzyl 1-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-1-cyclohexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]cyclohexanecarboxylic acid benzyl ester Formula: C28H36N2O5 MolecularWeight: 480.59584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H36N2O5/c1-27(2,3)35-26(33)29-23(19-21-13-7-4-8-14-21)24(31)30-28(17-11-6-12-18-28)25(32)34-20-22-15-9-5-10-16-22/h4-5,7-10,13-16,23H,6,11-12,17-20H2,1-3H3,(H,29,33)(H,30,31)/t23-/m0/s1