ethyl 2,4,6-trinitrobenzoate

Systemtic Name: ethyl 2,4,6-trinitrobenzoate Openeye Name: ethyl 2,4,6-trinitrobenzoate CAS Name: 2,4,6-trinitrobenzoic acid ethyl ester IUPAC Name: ethyl 2,4,6-trinitrobenzoate Traditional Name: 2,4,6-trinitrobenzoic acid ethyl ester Formula: C9H7N3O8 MolecularWeight: 285.16718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N3O8/c1-2-20-9(13)8-6(11(16)17)3-5(10(14)15)4-7(8)12(18)19/h3-4H,2H2,1H3