3-[4-[(2-bromanylcyclohexyl)methoxycarbonyloxy]cyclohexyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[4-[(2-bromanylcyclohexyl)methoxycarbonyloxy]cyclohexyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-[4-[(2-bromocyclohexyl)methoxycarbonyloxy]cyclohexyl]-2-(tert-butoxycarbonylamino)propanoic acid CAS Name: 3-[4-[(2-bromocyclohexyl)methoxy-oxomethoxy]cyclohexyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-[(2-bromocyclohexyl)methoxycarbonyloxy]cyclohexyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-[4-[(2-bromocyclohexyl)methoxycarbonyloxy]cyclohexyl]-2-(tert-butoxycarbonylamino)propionic acid Formula: C22H36BrNO7 MolecularWeight: 506.42774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCC(CC1)OC(=O)OCC2CCCCC2Br)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCC(CC1)OC(=O)OCC2CCCCC2Br)C(=O)O

InChI

InChI=1S/C22H36BrNO7/c1-22(2,3)31-20(27)24-18(19(25)26)12-14-8-10-16(11-9-14)30-21(28)29-13-15-6-4-5-7-17(15)23/h14-18H,4-13H2,1-3H3,(H,24,27)(H,25,26)