(2-chloranyl-4-fluoranyl-phenyl)methyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 1-nitro-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-nitro-9,10-dioxo-2-anthracenecarboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 1-nitro-9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketo-1-nitro-anthracene-2-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C22H11ClFNO6 MolecularWeight: 439.777243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC4=C(C=C(C=C4)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC4=C(C=C(C=C4)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H11ClFNO6/c23-17-9-12(24)6-5-11(17)10-31-22(28)16-8-7-15-18(19(16)25(29)30)21(27)14-4-2-1-3-13(14)20(15)26/h1-9H,10H2