dimethyl 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[2-(8-nitrooxyoctoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C25H34N2O8 MolecularWeight: 490.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2OCCCCCCCCO[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2OCCCCCCCCO[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C25H34N2O8/c1-17-21(24(28)32-3)23(22(18(2)26-17)25(29)33-4)19-13-9-10-14-20(19)34-15-11-7-5-6-8-12-16-35-27(30)31/h9-10,13-14,23,26H,5-8,11-12,15-16H2,1-4H3