N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C20H19N5O7 MolecularWeight: 441.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O7/c1-13(11-23-12-16(10-21-23)25(29)30)20(26)22-14-7-15(24(27)28)9-17(8-14)32-19-6-4-3-5-18(19)31-2/h3-10,12-13H,11H2,1-2H3,(H,22,26)