5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide CAS Name: 5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-nitrophenyl)-N-phenethyl-1H-pyrazole-4-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3/c23-18(19-11-10-13-4-2-1-3-5-13)16-12-20-21-17(16)14-6-8-15(9-7-14)22(24)25/h1-9,12H,10-11H2,(H,19,23)(H,20,21)