6-azanyl-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: 6-azanyl-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: 6-amino-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: 6-amino-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate IUPAC Name: 6-amino-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: 6-amino-2-methyl-3-(3-nitrooxypropyl)-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Formula: C17H18N4O9-2 MolecularWeight: 422.34622

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=C(N1)N)C(=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])(CCCO[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1C(C(C(=C(N1)N)C(=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])(CCCO[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H20N4O9/c1-9-17(16(24)25,6-3-7-30-21(28)29)13(12(15(22)23)14(18)19-9)10-4-2-5-11(8-10)20(26)27/h2,4-5,8-9,13,19H,3,6-7,18H2,1H3,(H,22,23)(H,24,25)/p-2