(2S,7S)-2,7-bis[(2-methylpropan-2-yl)oxycarbonylamino]oct-4-ynedioic acid

Systemtic Name: (2S,7S)-2,7-bis[(2-methylpropan-2-yl)oxycarbonylamino]oct-4-ynedioic acid Openeye Name: (2S,7S)-2,7-bis(tert-butoxycarbonylamino)oct-4-ynedioic acid CAS Name: (2S,7S)-2,7-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-octynedioic acid IUPAC Name: (2S,7S)-2,7-bis[(2-methylpropan-2-yl)oxycarbonylamino]oct-4-ynedioic acid Traditional Name: (2S,7S)-2,7-bis(tert-butoxycarbonylamino)oct-4-ynedioic acid Formula: C18H28N2O8 MolecularWeight: 400.42352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#CCC(C(=O)O)NC(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC#CC[C@@H](C(=O)O)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C18H28N2O8/c1-17(2,3)27-15(25)19-11(13(21)22)9-7-8-10-12(14(23)24)20-16(26)28-18(4,5)6/h11-12H,9-10H2,1-6H3,(H,19,25)(H,20,26)(H,21,22)(H,23,24)/t11-,12-/m0/s1