5-(4-methylphenyl)-2-[1-(4-methylphenyl)-2-nitro-ethoxy]-3,3-dinitro-1,2-oxazolidine

Systemtic Name: 5-(4-methylphenyl)-2-[1-(4-methylphenyl)-2-nitro-ethoxy]-3,3-dinitro-1,2-oxazolidine Openeye Name: 3,3-dinitro-2-[2-nitro-1-(p-tolyl)ethoxy]-5-(p-tolyl)isoxazolidine CAS Name: 5-(4-methylphenyl)-2-[1-(4-methylphenyl)-2-nitroethoxy]-3,3-dinitroisoxazolidine IUPAC Name: 5-(4-methylphenyl)-2-[1-(4-methylphenyl)-2-nitroethoxy]-3,3-dinitro-1,2-oxazolidine Traditional Name: 3,3-dinitro-2-[2-nitro-1-(p-tolyl)ethoxy]-5-(p-tolyl)isoxazolidine Formula: C19H20N4O8 MolecularWeight: 432.3841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(N(O2)OC(C[N+](=O)[O-])C3=CC=C(C=C3)C)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(N(O2)OC(C[N+](=O)[O-])C3=CC=C(C=C3)C)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O8/c1-13-3-7-15(8-4-13)17-11-19(21(26)27,22(28)29)23(30-17)31-18(12-20(24)25)16-9-5-14(2)6-10-16/h3-10,17-18H,11-12H2,1-2H3