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

Systemtic Name: dipropan-2-yl 4-(2-methoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diisopropyl 4-(2-methoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-methoxy-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-methoxy-3,5-dinitro-6-pentadecylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-methoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diisopropyl ester Formula: C37H57N3O9 MolecularWeight: 687.86318

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C37H57N3O9/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28-29(39(43)44)23-30(40(45)46)35(47-8)33(28)34-31(36(41)48-24(2)3)26(6)38-27(7)32(34)37(42)49-25(4)5/h23-25,34,38H,9-22H2,1-8H3