(phenylmethyl) (3aS,6S,6aR)-4-(2-acetyloxyethanoyl)-5-oxidanylidene-6-prop-2-enyl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate

Systemtic Name: (phenylmethyl) (3aS,6S,6aR)-4-(2-acetyloxyethanoyl)-5-oxidanylidene-6-prop-2-enyl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate Openeye Name: benzyl (3aS,6S,6aR)-4-(2-acetoxyacetyl)-6-allyl-5-oxo-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate CAS Name: (3aS,6S,6aR)-4-(2-acetyloxy-1-oxoethyl)-5-oxo-6-prop-2-enyl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3aS,6S,6aR)-4-(2-acetyloxyacetyl)-5-oxo-6-prop-2-enyl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate Traditional Name: (3aS,6S,6aR)-4-(2-acetoxyacetyl)-6-allyl-5-keto-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylic acid benzyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)N1C2CCN(C2C(C1=O)CC=C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OCC(=O)N1[C@H]2CCN([C@@H]2[C@@H](C1=O)CC=C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O6/c1-3-7-16-19-17(23(20(16)26)18(25)13-28-14(2)24)10-11-22(19)21(27)29-12-15-8-5-4-6-9-15/h3-6,8-9,16-17,19H,1,7,10-13H2,2H3/t16-,17-,19+/m0/s1