O3-(3-nitrooxypropyl) O5-propan-2-yl 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(3-nitrooxypropyl) O5-propan-2-yl 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(3-nitrooxypropyl) 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-methyl-5-nitro-4-imidazolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(3-nitrooxypropyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(3-nitrooxypropyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-methyl-5-nitroimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-(3-nitrooxypropyl) ester Formula: C19H25N5O9 MolecularWeight: 467.4299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCCO[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O9/c1-10(2)33-19(26)14-12(4)21-11(3)13(18(25)31-7-6-8-32-24(29)30)15(14)16-17(23(27)28)20-9-22(16)5/h9-10,15,21H,6-8H2,1-5H3