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

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C31H26N4O5 MolecularWeight: 534.56194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H26N4O5/c1-21-14-22(2)16-28(15-21)40-29-18-25(17-26(19-29)35(37)38)32-31(36)30-12-13-34(33-30)20-39-27-10-8-24(9-11-27)23-6-4-3-5-7-23/h3-19H,20H2,1-2H3,(H,32,36)