1-[3-(2-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]butan-1-one

Systemtic Name: 1-[3-(2-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]butan-1-one Openeye Name: 1-[3-(2-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]butan-1-one CAS Name: 1-[3-(2-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-1-butanone IUPAC Name: 1-[3-(2-nitrophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]butan-1-one Traditional Name: 1-[5-(2-nitrophenyl)-3-phenyl-3-pyrazolin-1-yl]butan-1-one Formula: C19H19N3O3 MolecularWeight: 337.37246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(C=C(N1)C2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)N1C(C=C(N1)C2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O3/c1-2-8-19(23)21-18(15-11-6-7-12-17(15)22(24)25)13-16(20-21)14-9-4-3-5-10-14/h3-7,9-13,18,20H,2,8H2,1H3