3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1H-pyrazole-5-carboxamide Formula: C25H21ClN4O4 MolecularWeight: 476.91164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H21ClN4O4/c1-14-8-15(2)16(3)24(9-14)34-21-11-19(10-20(12-21)30(32)33)27-25(31)23-13-22(28-29-23)17-4-6-18(26)7-5-17/h4-13H,1-3H3,(H,27,31)(H,28,29)