O5-hexyl O3-(6-nitrooxyhexyl) 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-hexyl O3-(6-nitrooxyhexyl) 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-hexyl O3-(6-nitrooxyhexyl) 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-hexyl ester O3-(6-nitrooxyhexyl) ester IUPAC Name: 5-O-hexyl 3-O-(6-nitrooxyhexyl) 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-hexyl ester O3-(6-nitrooxyhexyl) ester Formula: C26H36N4O9 MolecularWeight: 548.58544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCCCCCO[N+](=O)[O-])N)C

Isomeric SMILES

CCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCCCCCO[N+](=O)[O-])N)C

InChI

InChI=1S/C26H36N4O9/c1-3-4-5-8-14-37-25(31)21-18(2)28-24(27)23(22(21)19-12-11-13-20(17-19)29(33)34)26(32)38-15-9-6-7-10-16-39-30(35)36/h11-13,17,22,28H,3-10,14-16,27H2,1-2H3