bis(4-iodanylbutyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(4-iodanylbutyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis(4-iodobutyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(4-iodobutyl) ester IUPAC Name: bis(4-iodobutyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(4-iodobutyl) ester Formula: C23H28I2N2O6 MolecularWeight: 682.28716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCCCI)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCCCI

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCCCI)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCCCI

InChI

InChI=1S/C23H28I2N2O6/c1-15-19(22(28)32-12-5-3-10-24)21(17-8-7-9-18(14-17)27(30)31)20(16(2)26-15)23(29)33-13-6-4-11-25/h7-9,14,21,26H,3-6,10-13H2,1-2H3