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

Systemtic Name: diethyl 4-(3,5-dinitro-2-pentadecyl-6-propan-2-yloxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(2-isopropoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(3,5-dinitro-2-pentadecyl-6-propan-2-yloxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3,5-dinitro-2-pentadecyl-6-propan-2-yloxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-isopropoxy-3,5-dinitro-6-pentadecyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl 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(C)C)C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C37H57N3O9/c1-8-11-12-13-14-15-16-17-18-19-20-21-22-23-28-29(39(43)44)24-30(40(45)46)35(49-25(4)5)33(28)34-31(36(41)47-9-2)26(6)38-27(7)32(34)37(42)48-10-3/h24-25,34,38H,8-23H2,1-7H3