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

Systemtic Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C32H28N4O5 MolecularWeight: 548.58852

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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=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5)C)C

InChI

InChI=1S/C32H28N4O5/c1-21-15-22(2)23(3)31(16-21)41-29-18-26(17-27(19-29)36(38)39)33-32(37)30-13-14-35(34-30)20-40-28-11-9-25(10-12-28)24-7-5-4-6-8-24/h4-19H,20H2,1-3H3,(H,33,37)