(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-heptanedioic acid

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-heptanedioic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-6-oxo-heptanedioic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxoheptanedioic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxoheptanedioic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-6-keto-pimelic acid Formula: C12H19NO7 MolecularWeight: 289.28176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO7/c1-12(2,3)20-11(19)13-7(9(15)16)5-4-6-8(14)10(17)18/h7H,4-6H2,1-3H3,(H,13,19)(H,15,16)(H,17,18)/t7-/m0/s1