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anthracene; 4-bromanyl-2,5,7-trinitro-fluoren-9-one

anthracene; 4-bromanyl-2,5,7-trinitro-fluoren-9-one

Systemtic Name:anthracene; 4-bromanyl-2,5,7-trinitro-fluoren-9-one
Openeye Name:anthracene; 4-bromo-2,5,7-trinitro-fluoren-9-one
CAS Name:anthracene; 4-bromo-2,5,7-trinitro-9-fluorenone
IUPAC Name:anthracene; 4-bromo-2,5,7-trinitrofluoren-9-one
Traditional Name:anthracene; 4-bromo-2,5,7-trinitro-fluoren-9-one
Formula: C27H14BrN3O7
MolecularWeight: 572.31996
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C=CC=CC3=CC2=C1.C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3C2=O)[N+](=O)[O-])Br)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C=C3C=CC=CC3=CC2=C1.C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3C2=O)[N+](=O)[O-])Br)[N+](=O)[O-]


InChI

InChI=1S/C14H10.C13H4BrN3O7/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;14-9-3-5(15(19)20)1-7-11(9)12-8(13(7)18)2-6(16(21)22)4-10(12)17(23)24/h1-10H;1-4H


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