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

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-N-pentyl-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-N-pentylpyrazole-3-carboxamide Traditional Name: N-amyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3/c1-4-5-6-13-24-23(28)22-15-21(18-8-7-16(2)17(3)14-18)25-26(22)19-9-11-20(12-10-19)27(29)30/h7-12,14-15H,4-6,13H2,1-3H3,(H,24,28)