methyl 4-(4-ethoxyphenoxy)-3,5-dinitro-benzoate

Systemtic Name: methyl 4-(4-ethoxyphenoxy)-3,5-dinitro-benzoate Openeye Name: methyl 4-(4-ethoxyphenoxy)-3,5-dinitro-benzoate CAS Name: 4-(4-ethoxyphenoxy)-3,5-dinitrobenzoic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenoxy)-3,5-dinitrobenzoate Traditional Name: 4-(4-ethoxyphenoxy)-3,5-dinitro-benzoic acid methyl ester Formula: C16H14N2O8 MolecularWeight: 362.29096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O8/c1-3-25-11-4-6-12(7-5-11)26-15-13(17(20)21)8-10(16(19)24-2)9-14(15)18(22)23/h4-9H,3H2,1-2H3