(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(propanoylamino)pentanedioic acid

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(propanoylamino)pentanedioic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-4-(propanoylamino)pentanedioic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(1-oxopropylamino)pentanedioic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(propanoylamino)pentanedioic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-4-propionamido-glutaric acid Formula: C13H22N2O7 MolecularWeight: 318.32298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)NC(C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C13H22N2O7/c1-5-9(16)14-7(10(17)18)6-8(11(19)20)15-12(21)22-13(2,3)4/h7-8H,5-6H2,1-4H3,(H,14,16)(H,15,21)(H,17,18)(H,19,20)/t7?,8-/m0/s1