1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: 1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: 1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-3,5-dimethylpyrazole-4-carboxamide Traditional Name: 1-ethyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-3,5-dimethyl-pyrazole-4-carboxamide Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C21H22N4O5/c1-5-24-14(3)20(13(2)23-24)21(26)22-15-10-16(25(27)28)12-19(11-15)30-18-8-6-17(29-4)7-9-18/h6-12H,5H2,1-4H3,(H,22,26)