(2-morpholin-4-yl-2-oxidanylidene-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (2-morpholino-2-oxo-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (2-keto-2-morpholino-ethyl) ester Formula: C14H14N2O8 MolecularWeight: 338.26956

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

C1COCCN1C(=O)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C14H14N2O8/c17-13(15-1-3-21-4-2-15)7-22-14(18)9-5-11-12(24-8-23-11)6-10(9)16(19)20/h5-6H,1-4,7-8H2