[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(4-ethylpiperazin-1-yl)methanone

Systemtic Name: [2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(4-ethylpiperazin-1-yl)methanone Openeye Name: [2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(4-ethylpiperazin-1-yl)methanone CAS Name: [2-(3-chlorophenyl)-5-(4-nitrophenyl)-3-pyrazolyl]-(4-ethyl-1-piperazinyl)methanone IUPAC Name: [2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(4-ethylpiperazin-1-yl)methanone Traditional Name: [2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-(4-ethylpiperazino)methanone Formula: C22H22ClN5O3 MolecularWeight: 439.89478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN5O3/c1-2-25-10-12-26(13-11-25)22(29)21-15-20(16-6-8-18(9-7-16)28(30)31)24-27(21)19-5-3-4-17(23)14-19/h3-9,14-15H,2,10-13H2,1H3