dimethyl 4-(2-ethoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(2-ethoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(2-ethoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-ethoxy-3,5-dinitro-6-pentadecylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(2-ethoxy-3,5-dinitro-6-pentadecylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-ethoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C34H51N3O9 MolecularWeight: 645.78344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCC)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCC)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)OC

InChI

InChI=1S/C34H51N3O9/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-25-26(36(40)41)22-27(37(42)43)32(46-8-2)30(25)31-28(33(38)44-5)23(3)35-24(4)29(31)34(39)45-6/h22,31,35H,7-21H2,1-6H3