3-methylbutyl 9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxylate

Systemtic Name: 3-methylbutyl 9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxylate Openeye Name: isopentyl 9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxylate CAS Name: 9-hydroxyimino-2,5,7-trinitro-4-fluorenecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 9-hydroxyimino-2,5,7-trinitrofluorene-4-carboxylate Traditional Name: 9-hydroximino-2,5,7-trinitro-fluorene-4-carboxylic acid isoamyl ester Formula: C19H16N4O9 MolecularWeight: 444.35174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=NO)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=NO)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O9/c1-9(2)3-4-32-19(24)14-7-10(21(26)27)5-12-16(14)17-13(18(12)20-25)6-11(22(28)29)8-15(17)23(30)31/h5-9,25H,3-4H2,1-2H3