1-[5-(5-chloranyl-2-nitro-phenyl)-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[5-(5-chloranyl-2-nitro-phenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[5-(5-chloro-2-nitro-phenyl)-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[5-(5-chloro-2-nitrophenyl)-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[5-(5-chloro-2-nitrophenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[3-(5-chloro-2-nitro-phenyl)-2-pyrazolin-1-yl]propan-1-one Formula: C12H12ClN3O3 MolecularWeight: 281.69498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(=N1)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1CCC(=N1)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O3/c1-2-12(17)15-6-5-10(14-15)9-7-8(13)3-4-11(9)16(18)19/h3-4,7H,2,5-6H2,1H3