N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O6/c1-14(16-12-15(29-2)8-9-19(16)30-3)22-21(26)17-10-11-24(23-17)13-31-20-7-5-4-6-18(20)25(27)28/h4-12,14H,13H2,1-3H3,(H,22,26)