3,3-dinitro-6-[1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]cyclohexa-1,4-diene

Systemtic Name: 3,3-dinitro-6-[1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]cyclohexa-1,4-diene Openeye Name: 3,3-dinitro-6-[1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]cyclohexa-1,4-diene CAS Name: 3,3-dinitro-6-[1-(trifluoromethyl)-1-cyclohexa-2,4-dienyl]cyclohexa-1,4-diene IUPAC Name: 3,3-dinitro-6-[1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]cyclohexa-1,4-diene Traditional Name: 3,3-dinitro-6-[1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]cyclohexa-1,4-diene Formula: C13H11F3N2O4 MolecularWeight: 316.23265

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=CC1(C2C=CC(C=C2)([N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1C=CC=CC1(C2C=CC(C=C2)([N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H11F3N2O4/c14-13(15,16)11(6-2-1-3-7-11)10-4-8-12(9-5-10,17(19)20)18(21)22/h1-6,8-10H,7H2