(4-pentoxyphenyl) 2,4-dinitrobenzoate

Systemtic Name: (4-pentoxyphenyl) 2,4-dinitrobenzoate Openeye Name: (4-pentoxyphenyl) 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid (4-pentoxyphenyl) ester IUPAC Name: (4-pentoxyphenyl) 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid (4-amoxyphenyl) ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7/c1-2-3-4-11-26-14-6-8-15(9-7-14)27-18(21)16-10-5-13(19(22)23)12-17(16)20(24)25/h5-10,12H,2-4,11H2,1H3