methyl (9Z)-9-[(4-chlorophenyl)methylidene]-2,5,7-trinitro-fluorene-4-carboxylate

Systemtic Name: methyl (9Z)-9-[(4-chlorophenyl)methylidene]-2,5,7-trinitro-fluorene-4-carboxylate Openeye Name: methyl (9Z)-9-[(4-chlorophenyl)methylene]-2,5,7-trinitro-fluorene-4-carboxylate CAS Name: (9Z)-9-[(4-chlorophenyl)methylidene]-2,5,7-trinitro-4-fluorenecarboxylic acid methyl ester IUPAC Name: methyl (9Z)-9-[(4-chlorophenyl)methylidene]-2,5,7-trinitrofluorene-4-carboxylate Traditional Name: (9Z)-9-(4-chlorobenzylidene)-2,5,7-trinitro-fluorene-4-carboxylic acid methyl ester Formula: C22H12ClN3O8 MolecularWeight: 481.79898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=CC3=CC=C(C=C3)Cl)C4=CC(=CC(=C42)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])/C(=C/C3=CC=C(C=C3)Cl)/C4=CC(=CC(=C42)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H12ClN3O8/c1-34-22(27)18-9-13(24(28)29)7-16-15(6-11-2-4-12(23)5-3-11)17-8-14(25(30)31)10-19(26(32)33)21(17)20(16)18/h2-10H,1H3/b15-6-