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

Systemtic Name: O3-(2-nitrooxypropyl) O5-(3-nitrooxypropyl) 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-nitrooxypropyl) O5-(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 O3-(2-nitrooxypropyl) ester O5-(3-nitrooxypropyl) ester IUPAC Name: 3-O-(2-nitrooxypropyl) 5-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 O3-(2-nitrooxypropyl) ester O5-(3-nitrooxypropyl) ester Formula: C20H23N5O12 MolecularWeight: 525.42292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O12/c1-11(37-25(32)33)10-35-20(27)17-16(13-5-3-6-14(9-13)23(28)29)15(12(2)22-18(17)21)19(26)34-7-4-8-36-24(30)31/h3,5-6,9,11,16,22H,4,7-8,10,21H2,1-2H3