methyl (2R)-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[1-(tert-butoxycarbonylamino)cyclohexanecarbonyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclohexyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexanecarbonyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[1-(tert-butoxycarbonylamino)cyclohexanecarbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCCCC1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCCCC1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C22H32N2O5/c1-21(2,3)29-20(27)24-22(13-9-6-10-14-22)19(26)23-17(18(25)28-4)15-16-11-7-5-8-12-16/h5,7-8,11-12,17H,6,9-10,13-15H2,1-4H3,(H,23,26)(H,24,27)/t17-/m1/s1