ethyl 5-nitro-1,3-benzodioxole-4-carboxylate

Systemtic Name: ethyl 5-nitro-1,3-benzodioxole-4-carboxylate Openeye Name: ethyl 5-nitro-1,3-benzodioxole-4-carboxylate CAS Name: 5-nitro-1,3-benzodioxole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-1,3-benzodioxole-4-carboxylate Traditional Name: 5-nitro-1,3-benzodioxole-4-carboxylic acid ethyl ester Formula: C10H9NO6 MolecularWeight: 239.18156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC2=C1OCO2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C=CC2=C1OCO2)[N+](=O)[O-]

InChI

InChI=1S/C10H9NO6/c1-2-15-10(12)8-6(11(13)14)3-4-7-9(8)17-5-16-7/h3-4H,2,5H2,1H3