N-[2-(ethylamino)-2-oxidanylidene-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[2-(ethylamino)-2-oxidanylidene-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[2-(ethylamino)-2-oxo-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[2-(ethylamino)-2-oxoethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[2-(ethylamino)-2-oxoethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(ethylamino)-2-keto-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C13H15N3O6 MolecularWeight: 309.2747

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CNC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCCO2

Isomeric SMILES

CCNC(=O)CNC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCCO2

InChI

InChI=1S/C13H15N3O6/c1-2-14-12(17)7-15-13(18)8-5-10-11(22-4-3-21-10)6-9(8)16(19)20/h5-6H,2-4,7H2,1H3,(H,14,17)(H,15,18)