diethyl 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C20H22N2O8 MolecularWeight: 418.39728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OCC)C)C

InChI

InChI=1S/C20H22N2O8/c1-5-27-19(23)16-10(3)21-11(4)17(20(24)28-6-2)18(16)12-7-14-15(30-9-29-14)8-13(12)22(25)26/h7-8,18,21H,5-6,9H2,1-4H3