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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCC(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCC(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H26N4O3/c1-15(2)11-12-24-23(28)22-14-21(18-6-5-16(3)17(4)13-18)25-26(22)19-7-9-20(10-8-19)27(29)30/h5-10,13-15H,11-12H2,1-4H3,(H,24,28)