N-[3-(2-methylphenoxy)-5-nitro-phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=CC=C4

InChI

InChI=1S/C24H20N4O5/c1-17-7-5-6-10-23(17)33-21-14-18(13-19(15-21)28(30)31)25-24(29)22-11-12-27(26-22)16-32-20-8-3-2-4-9-20/h2-15H,16H2,1H3,(H,25,29)