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

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C19H17N5O7 MolecularWeight: 427.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O7/c1-2-30-13-7-8-14(17(11-13)24(28)29)20-19(25)15-9-10-22(21-15)12-31-18-6-4-3-5-16(18)23(26)27/h3-11H,2,12H2,1H3,(H,20,25)