5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propyl-pyrazole-3-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propyl-pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propyl-pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propyl-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propylpyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-propyl-pyrazole-3-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCNC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H22N4O3/c1-4-10-22-21(26)20-13-19(16-9-8-14(2)15(3)11-16)23-24(20)17-6-5-7-18(12-17)25(27)28/h5-9,11-13H,4,10H2,1-3H3,(H,22,26)