tert-butyl 2,4-bis(4-ethoxy-4-oxidanylidene-butoxy)-5-nitro-benzoate

Systemtic Name: tert-butyl 2,4-bis(4-ethoxy-4-oxidanylidene-butoxy)-5-nitro-benzoate Openeye Name: tert-butyl 2,4-bis(4-ethoxy-4-oxo-butoxy)-5-nitro-benzoate CAS Name: 2,4-bis(4-ethoxy-4-oxobutoxy)-5-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2,4-bis(4-ethoxy-4-oxobutoxy)-5-nitrobenzoate Traditional Name: 2,4-bis(4-ethoxy-4-keto-butoxy)-5-nitro-benzoic acid tert-butyl ester Formula: C23H33NO10 MolecularWeight: 483.50882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC(=C(C=C1C(=O)OC(C)(C)C)[N+](=O)[O-])OCCCC(=O)OCC

Isomeric SMILES

CCOC(=O)CCCOC1=CC(=C(C=C1C(=O)OC(C)(C)C)[N+](=O)[O-])OCCCC(=O)OCC

InChI

InChI=1S/C23H33NO10/c1-6-30-20(25)10-8-12-32-18-15-19(33-13-9-11-21(26)31-7-2)17(24(28)29)14-16(18)22(27)34-23(3,4)5/h14-15H,6-13H2,1-5H3