N-(4-ethoxy-2-nitro-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C13H13N5O7 MolecularWeight: 351.27162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O7/c1-3-25-7-4-5-8(9(6-7)17(20)21)14-12(19)10-11(18(22)23)13(24-2)16-15-10/h4-6H,3H2,1-2H3,(H,14,19)(H,15,16)