(3E,7E)-3,7-bis[(4-nitrophenyl)methylidene]cycloheptane-1,2-dione

Systemtic Name: (3E,7E)-3,7-bis[(4-nitrophenyl)methylidene]cycloheptane-1,2-dione Openeye Name: (3E,7E)-3,7-bis[(4-nitrophenyl)methylene]cycloheptane-1,2-dione CAS Name: (3E,7E)-3,7-bis[(4-nitrophenyl)methylidene]cycloheptane-1,2-dione IUPAC Name: (3E,7E)-3,7-bis[(4-nitrophenyl)methylidene]cycloheptane-1,2-dione Traditional Name: (3E,7E)-3,7-bis(4-nitrobenzylidene)cycloheptane-1,2-quinone Formula: C21H16N2O6 MolecularWeight: 392.36154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])C1

Isomeric SMILES

C1C/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C1

InChI

InChI=1S/C21H16N2O6/c24-20-16(12-14-4-8-18(9-5-14)22(26)27)2-1-3-17(21(20)25)13-15-6-10-19(11-7-15)23(28)29/h4-13H,1-3H2/b16-12+,17-13+