(2R,3R,4R)-3-chloranyl-3,6-dinitro-2-(4-nitrophenyl)-2,4-dihydrochromen-4-ol

Systemtic Name: (2R,3R,4R)-3-chloranyl-3,6-dinitro-2-(4-nitrophenyl)-2,4-dihydrochromen-4-ol Openeye Name: (2R,3R,4R)-3-chloro-3,6-dinitro-2-(4-nitrophenyl)chroman-4-ol CAS Name: (2R,3R,4R)-3-chloro-3,6-dinitro-2-(4-nitrophenyl)-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: (2R,3R,4R)-3-chloro-3,6-dinitro-2-(4-nitrophenyl)-2,4-dihydrochromen-4-ol Traditional Name: (2R,3R,4R)-3-chloro-3,6-dinitro-2-(4-nitrophenyl)chroman-4-ol Formula: C15H10ClN3O8 MolecularWeight: 395.7082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(C(C3=C(O2)C=CC(=C3)[N+](=O)[O-])O)([N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[C@@H]2[C@]([C@@H](C3=C(O2)C=CC(=C3)[N+](=O)[O-])O)([N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H10ClN3O8/c16-15(19(25)26)13(20)11-7-10(18(23)24)5-6-12(11)27-14(15)8-1-3-9(4-2-8)17(21)22/h1-7,13-14,20H/t13-,14-,15+/m1/s1