(phenylmethyl) (6R,8aR)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-1,2,3,6,7,8-hexahydroindolizine-8a-carboxylate

Systemtic Name: (phenylmethyl) (6R,8aR)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-1,2,3,6,7,8-hexahydroindolizine-8a-carboxylate Openeye Name: benzyl (6R,8aR)-6-(tert-butoxycarbonylamino)-5-oxo-1,2,3,6,7,8-hexahydroindolizine-8a-carboxylate CAS Name: (6R,8aR)-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxo-1,2,3,6,7,8-hexahydroindolizine-8a-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (6R,8aR)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-1,2,3,6,7,8-hexahydroindolizine-8a-carboxylate Traditional Name: (6R,8aR)-6-(tert-butoxycarbonylamino)-5-keto-indolizidine-8a-carboxylic acid benzyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC2(CCCN2C1=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[C@]2(CCCN2C1=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O5/c1-20(2,3)28-19(26)22-16-10-12-21(11-7-13-23(21)17(16)24)18(25)27-14-15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-14H2,1-3H3,(H,22,26)/t16-,21-/m1/s1