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

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-[(2-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5/c1-3-28-15-8-9-16(18(12-15)24(26)27)21-20(25)17-10-11-23(22-17)13-29-19-7-5-4-6-14(19)2/h4-12H,3,13H2,1-2H3,(H,21,25)