(4-propoxycarbonylphenyl) 2,4-dinitrobenzoate

Systemtic Name: (4-propoxycarbonylphenyl) 2,4-dinitrobenzoate Openeye Name: (4-propoxycarbonylphenyl) 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [4-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (4-propoxycarbonylphenyl) 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid (4-propoxycarbonylphenyl) ester Formula: C17H14N2O8 MolecularWeight: 374.30166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O8/c1-2-9-26-16(20)11-3-6-13(7-4-11)27-17(21)14-8-5-12(18(22)23)10-15(14)19(24)25/h3-8,10H,2,9H2,1H3