N-(2-methyl-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-(2-methyl-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-(2-methyl-4-nitrophenyl)-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-methyl-4-nitrophenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-(2-methyl-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C18H16N4O4 MolecularWeight: 352.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O4/c1-13-11-14(22(24)25)7-8-16(13)19-18(23)17-9-10-21(20-17)12-26-15-5-3-2-4-6-15/h2-11H,12H2,1H3,(H,19,23)