N-(4-ethoxy-2-nitro-phenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C13H13N5O6 MolecularWeight: 335.27222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5O6/c1-3-24-8-4-5-9(10(6-8)17(20)21)14-13(19)12-11(18(22)23)7-16(2)15-12/h4-7H,3H2,1-2H3,(H,14,19)