4,6-bis(aziridin-1-yl)-2-(4-methoxy-3-nitro-phenyl)-5-nitro-pyrimidine

Systemtic Name: 4,6-bis(aziridin-1-yl)-2-(4-methoxy-3-nitro-phenyl)-5-nitro-pyrimidine Openeye Name: 4,6-bis(aziridin-1-yl)-2-(4-methoxy-3-nitro-phenyl)-5-nitro-pyrimidine CAS Name: 4,6-bis(1-aziridinyl)-2-(4-methoxy-3-nitrophenyl)-5-nitropyrimidine IUPAC Name: 4,6-bis(aziridin-1-yl)-2-(4-methoxy-3-nitrophenyl)-5-nitropyrimidine Traditional Name: 4,6-diethylenimino-2-(4-methoxy-3-nitro-phenyl)-5-nitro-pyrimidine Formula: C15H14N6O5 MolecularWeight: 358.30886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(C(=N2)N3CC3)[N+](=O)[O-])N4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(C(=N2)N3CC3)[N+](=O)[O-])N4CC4)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O5/c1-26-11-3-2-9(8-10(11)20(22)23)13-16-14(18-4-5-18)12(21(24)25)15(17-13)19-6-7-19/h2-3,8H,4-7H2,1H3