butyl 4-chloranyl-3,5-dinitro-benzoate

Systemtic Name: butyl 4-chloranyl-3,5-dinitro-benzoate Openeye Name: butyl 4-chloro-3,5-dinitro-benzoate CAS Name: 4-chloro-3,5-dinitrobenzoic acid butyl ester IUPAC Name: butyl 4-chloro-3,5-dinitrobenzoate Traditional Name: 4-chloro-3,5-dinitro-benzoic acid butyl ester Formula: C11H11ClN2O6 MolecularWeight: 302.66784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H11ClN2O6/c1-2-3-4-20-11(15)7-5-8(13(16)17)10(12)9(6-7)14(18)19/h5-6H,2-4H2,1H3