4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide

Systemtic Name: 4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide Openeye Name: 4-methyl-5-(2-nitrophenoxy)-N-propyl-1-(p-tolyl)pyrazole-3-carboxamide CAS Name: 4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-3-pyrazolecarboxamide IUPAC Name: 4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propylpyrazole-3-carboxamide Traditional Name: 4-methyl-5-(2-nitrophenoxy)-N-propyl-1-(p-tolyl)pyrazole-3-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN(C(=C1C)OC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)C

Isomeric SMILES

CCCNC(=O)C1=NN(C(=C1C)OC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N4O4/c1-4-13-22-20(26)19-15(3)21(24(23-19)16-11-9-14(2)10-12-16)29-18-8-6-5-7-17(18)25(27)28/h5-12H,4,13H2,1-3H3,(H,22,26)