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

Systemtic Name: dimethyl 4-(3,5-dinitro-2-pentadecyl-6-propan-2-yloxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C35H53N3O9 MolecularWeight: 659.81002

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

Isomeric SMILES

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

InChI

InChI=1S/C35H53N3O9/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-27(37(41)42)22-28(38(43)44)33(47-23(2)3)31(26)32-29(34(39)45-6)24(4)36-25(5)30(32)35(40)46-7/h22-23,32,36H,8-21H2,1-7H3