3-methylbutyl (9E)-9-hydroxyimino-2,7-dinitro-fluorene-4-carboxylate

Systemtic Name: 3-methylbutyl (9E)-9-hydroxyimino-2,7-dinitro-fluorene-4-carboxylate Openeye Name: isopentyl (9E)-9-hydroxyimino-2,7-dinitro-fluorene-4-carboxylate CAS Name: (9E)-9-hydroxyimino-2,7-dinitro-4-fluorenecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (9E)-9-hydroxyimino-2,7-dinitrofluorene-4-carboxylate Traditional Name: (9E)-9-hydroximino-2,7-dinitro-fluorene-4-carboxylic acid isoamyl ester Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=NO)C2=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC(=O)C1=C2C3=C(C=C(C=C3)[N+](=O)[O-])/C(=N\O)/C2=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O7/c1-10(2)5-6-29-19(23)16-9-12(22(27)28)8-15-17(16)13-4-3-11(21(25)26)7-14(13)18(15)20-24/h3-4,7-10,24H,5-6H2,1-2H3/b20-18+