O3-(6-bromanylhexyl) O5-methyl 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-(6-bromanylhexyl) O5-methyl 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-(6-bromohexyl) O5-methyl 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-(6-bromohexyl) ester O5-methyl ester IUPAC Name: 3-O-(6-bromohexyl) 5-O-methyl 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: 6-methyl-3-(4-nitrophenyl)-2-(trifluoromethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-(6-bromohexyl) ester O5-methyl ester Formula: C22H26BrF3N2O6 MolecularWeight: 551.35085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(N1)C(F)(F)F)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCCCCBr)C(=O)OC

Isomeric SMILES

CC1=C(CC(C(N1)C(F)(F)F)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCCCCBr)C(=O)OC

InChI

InChI=1S/C22H26BrF3N2O6/c1-14-17(18(29)33-2)13-21(19(27-14)22(24,25)26,15-7-9-16(10-8-15)28(31)32)20(30)34-12-6-4-3-5-11-23/h7-10,19,27H,3-6,11-13H2,1-2H3