diethyl 4-[5-acetyloxy-2-nitro-3,4-bis(oxidanyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-[5-acetyloxy-2-nitro-3,4-bis(oxidanyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(5-acetoxy-3,4-dihydroxy-2-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(5-acetyloxy-3,4-dihydroxy-2-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(5-acetyloxy-3,4-dihydroxy-2-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(5-acetoxy-3,4-dihydroxy-2-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C21H24N2O10 MolecularWeight: 464.42266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O10/c1-6-31-20(27)14-9(3)22-10(4)15(21(28)32-7-2)16(14)12-8-13(33-11(5)24)18(25)19(26)17(12)23(29)30/h8,16,22,25-26H,6-7H2,1-5H3