tert-butyl (2S)-2-[[(2S,3S)-1-ethoxy-3-methyl-3-oxidanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-2,5-dihydropyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(2S,3S)-1-ethoxy-3-methyl-3-oxidanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-2,5-dihydropyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(1S,2S)-1-ethoxycarbonyl-2-hydroxy-2-methyl-butyl]carbamoyl]-2,5-dihydropyrrole-1-carboxylate CAS Name: (2S)-2-[[[(2S,3S)-1-ethoxy-3-hydroxy-3-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-2,5-dihydropyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S,3S)-1-ethoxy-3-hydroxy-3-methyl-1-oxopentan-2-yl]carbamoyl]-2,5-dihydropyrrole-1-carboxylate Traditional Name: (2S)-2-[[(1S,2S)-1-carbethoxy-2-hydroxy-2-methyl-butyl]carbamoyl]-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C18H30N2O6 MolecularWeight: 370.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(C(=O)OCC)NC(=O)C1C=CCN1C(=O)OC(C)(C)C)O

Isomeric SMILES

CC[C@@](C)([C@@H](C(=O)OCC)NC(=O)[C@@H]1C=CCN1C(=O)OC(C)(C)C)O

InChI

InChI=1S/C18H30N2O6/c1-7-18(6,24)13(15(22)25-8-2)19-14(21)12-10-9-11-20(12)16(23)26-17(3,4)5/h9-10,12-13,24H,7-8,11H2,1-6H3,(H,19,21)/t12-,13+,18-/m0/s1