(3Z,3aR,4R,6aR)-3-[(4-nitrophenyl)methylidene]-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-dione

Systemtic Name: (3Z,3aR,4R,6aR)-3-[(4-nitrophenyl)methylidene]-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-dione Openeye Name: (3Z,3aR,4R,6aR)-3-[(4-nitrophenyl)methylene]-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-dione CAS Name: (3Z,3aR,4R,6aR)-3-[(4-nitrophenyl)methylidene]-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-dione IUPAC Name: (3Z,3aR,4R,6aR)-3-[(4-nitrophenyl)methylidene]-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-dione Traditional Name: (3Z,3aR,4R,6aR)-3-(4-nitrobenzylidene)-4-octyl-4,6a-dihydro-3aH-furo[3,4-b]furan-2,6-quinone Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C2C(C(=O)O1)OC(=O)C2=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC[C@@H]1[C@@H]\2[C@H](C(=O)O1)OC(=O)/C2=C\C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25NO6/c1-2-3-4-5-6-7-8-17-18-16(20(23)28-19(18)21(24)27-17)13-14-9-11-15(12-10-14)22(25)26/h9-13,17-19H,2-8H2,1H3/b16-13-/t17-,18-,19-/m1/s1