1-[(3,5-dinitrophenyl)methyl]-7-(trifluoromethyl)-2H-indazol-3-one

Systemtic Name: 1-[(3,5-dinitrophenyl)methyl]-7-(trifluoromethyl)-2H-indazol-3-one Openeye Name: 1-[(3,5-dinitrophenyl)methyl]-7-(trifluoromethyl)-2H-indazol-3-one CAS Name: 1-[(3,5-dinitrophenyl)methyl]-7-(trifluoromethyl)-2H-indazol-3-one IUPAC Name: 1-[(3,5-dinitrophenyl)methyl]-7-(trifluoromethyl)-2H-indazol-3-one Traditional Name: 1-(3,5-dinitrobenzyl)-7-(trifluoromethyl)indazolin-3-one Formula: C15H9F3N4O5 MolecularWeight: 382.25097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(F)(F)F)N(NC2=O)CC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)C(F)(F)F)N(NC2=O)CC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9F3N4O5/c16-15(17,18)12-3-1-2-11-13(12)20(19-14(11)23)7-8-4-9(21(24)25)6-10(5-8)22(26)27/h1-6H,7H2,(H,19,23)