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

Systemtic Name: dipropan-2-yl 4-(2-ethoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diisopropyl 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 dipropan-2-yl ester IUPAC Name: dipropan-2-yl 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 diisopropyl ester Formula: C38H59N3O9 MolecularWeight: 701.88976

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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)C)C(=O)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C38H59N3O9/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-29-30(40(44)45)24-31(41(46)47)36(48-10-2)34(29)35-32(37(42)49-25(3)4)27(7)39-28(8)33(35)38(43)50-26(5)6/h24-26,35,39H,9-23H2,1-8H3