4,6-bis(4-methyl-3-nitro-phenoxy)-5-nitro-pyrimidine

Systemtic Name: 4,6-bis(4-methyl-3-nitro-phenoxy)-5-nitro-pyrimidine Openeye Name: 4,6-bis(4-methyl-3-nitro-phenoxy)-5-nitro-pyrimidine CAS Name: 4,6-bis(4-methyl-3-nitrophenoxy)-5-nitropyrimidine IUPAC Name: 4,6-bis(4-methyl-3-nitrophenoxy)-5-nitropyrimidine Traditional Name: 4,6-bis(4-methyl-3-nitro-phenoxy)-5-nitro-pyrimidine Formula: C18H13N5O8 MolecularWeight: 427.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=C(C(=NC=N2)OC3=CC(=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=C(C(=NC=N2)OC3=CC(=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O8/c1-10-3-5-12(7-14(10)21(24)25)30-17-16(23(28)29)18(20-9-19-17)31-13-6-4-11(2)15(8-13)22(26)27/h3-9H,1-2H3