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

Systemtic Name: O5-methyl O3-(3-nitrooxypropyl) 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-methyl O3-(3-nitrooxypropyl) 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-methyl ester O3-(3-nitrooxypropyl) ester IUPAC Name: 5-O-methyl 3-O-(3-nitrooxypropyl) 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-methyl ester O3-(3-nitrooxypropyl) ester Formula: C18H20N4O9 MolecularWeight: 436.3728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O9/c1-10-13(17(23)29-2)14(11-5-3-6-12(9-11)21(25)26)15(16(19)20-10)18(24)30-7-4-8-31-22(27)28/h3,5-6,9,14,20H,4,7-8,19H2,1-2H3