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

Systemtic Name: O3-ethyl O5-(3-nitrooxypropyl) 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-(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-ethyl ester O5-(3-nitrooxypropyl) ester IUPAC Name: 3-O-ethyl 5-O-(3-nitrooxypropyl) 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 O3-ethyl ester O5-(3-nitrooxypropyl) ester Formula: C18H23N5O9 MolecularWeight: 453.40332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCCO[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCCO[N+](=O)[O-])C)C

InChI

InChI=1S/C18H23N5O9/c1-5-30-17(24)12-10(2)20-11(3)13(18(25)31-7-6-8-32-23(28)29)14(12)15-16(22(26)27)19-9-21(15)4/h9,14,20H,5-8H2,1-4H3