O4-ethyl O2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] ester IUPAC Name: 4-O-ethyl 2-O-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl] ester Formula: C19H20N2O8 MolecularWeight: 404.3707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C

InChI

InChI=1S/C19H20N2O8/c1-4-27-18(22)15-10(2)16(20-11(15)3)19(23)28-8-13-6-14(21(24)25)5-12-7-26-9-29-17(12)13/h5-6,20H,4,7-9H2,1-3H3