O5-ethyl O3-methyl 4-(2-decyl-6-methoxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 4-(2-decyl-6-methoxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 4-(2-decyl-6-methoxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-decyl-6-methoxy-3,5-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 4-(2-decyl-6-methoxy-3,5-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-decyl-6-methoxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C29H41N3O9 MolecularWeight: 575.65054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC)C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC)C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OC

InChI

InChI=1S/C29H41N3O9/c1-7-9-10-11-12-13-14-15-16-20-21(31(35)36)17-22(32(37)38)27(39-5)25(20)26-23(28(33)40-6)18(3)30-19(4)24(26)29(34)41-8-2/h17,26,30H,7-16H2,1-6H3